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RECEPTOR
STRUCTURE
SIGNAL PROTEIN
AUXILIARY PROTEIN
STRUCTURE LIGAND
ENDOGENOUS LIGAND
SODIUM ION SITE
REFERENCE
ANNOTATED
UniProt
 IUPHAR Receptor family Cl. Species Method
PDB
 Refined
structure
 Resolution Preferred
chain		 State
 Degree
active (%)
 % of Seq Family Subtype Note % of Seq Fusion Antibodies Name Type Function Name Type D2x50
S3x39		 Sodium in
structure		 Authors Reference PDB Date
OPSD Rhodopsin Opsins A Bovine X-ray 1F88 1F88_refined 2.8 A Inactive 22 97 - - - - - - Retinal (11-cis) PubChem
small-molecule Inverse agonist - - No No Palczewski K, Kumasaka T, Hori T, Behnke CA, Motoshima H, Fox BA, Le Trong I, Teller DC, Okada T, Stenkamp RE, Yamamoto M, Miyano M 10.1126/SCIENCE.289.5480.739 2000-08-04 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 1HZX - 2.8 A Inactive 22 98 - - - - - - Retinal (11-cis) PubChem
small-molecule Inverse agonist - - No No - 10.1021/BI0155091 2001-07-04 No
OPSD Rhodopsin Opsins A Bovine X-ray 1L9H - 2.6 A Inactive 22 98 - - - - - - Retinal (11-cis) PubChem
small-molecule Inverse agonist - - No No Okada T, Fujiyoshi Y, Silow M, Navarro J, Landau EM, Shichida Y 10.1073/PNAS.082666399 2002-05-15 No
OPSD Rhodopsin Opsins A Bovine X-ray 1GZM 1GZM_refined 2.7 A Inactive 22 94 - - - - - - Retinal (11-cis) PubChem
small-molecule Inverse agonist - - No No Li J, Edwards PC, Burghammer M, Villa C, Schertler GF 10.1016/J.JMB.2004.08.090 2003-11-20 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 1U19 1U19_refined 2.2 A Inactive 22 100 - - - - - - Retinal (11-cis) PubChem
small-molecule Inverse agonist - - No No Okada T, Sugihara M, Bondar AN, Elstner M, Entel P, Buss V 10.1016/J.JMB.2004.07.044 2004-10-12 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 2HPY - 2.8 B Inactive 22 100 - - - - - - Retinal (all-trans) PubChem
small-molecule Agonist - - No No Nakamichi H, Okada T 10.1073/PNAS.0601765103 2006-08-22 No
OPSD Rhodopsin Opsins A Bovine X-ray 2G87 - 2.6 A Inactive 22 100 - - - - - - Retinal (all-trans) PubChem
small-molecule Agonist - - No No Nakamichi H, Okada T 10.1002/ANIE.200600595 2006-09-02 No
OPSD Rhodopsin Opsins A Bovine X-ray 2I35 - 3.8 A Inactive 22 94 - - - - - - Retinal (11-cis) PubChem
small-molecule Inverse agonist - - No No Salom D, Lodowski DT, Stenkamp RE, Le Trong I, Golczak M, Jastrzebska B, Harris T, Ballesteros JA, Palczewski K 10.1073/PNAS.0608022103 2006-10-17 No
OPSD Rhodopsin Opsins A Bovine X-ray 2I36 - 4.1 A Inactive 22 94 - - - - - - Apo (no ligand)
none Apo (no ligand) - - No No Salom D, Lodowski DT, Stenkamp RE, Le Trong I, Golczak M, Jastrzebska B, Harris T, Ballesteros JA, Palczewski K 10.1073/PNAS.0608022103 2006-10-17 No
OPSD Rhodopsin Opsins A Bovine X-ray 2I37 - 4.2 A Inactive 22 91 - - - - - - Apo (no ligand)
none Apo (no ligand) - - No No Salom D, Lodowski DT, Stenkamp RE, Le Trong I, Golczak M, Jastrzebska B, Harris T, Ballesteros JA, Palczewski K 10.1073/PNAS.0608022103 2006-10-17 No
OPSD Rhodopsin Opsins A Bovine X-ray 2J4Y - 3.4 B Inactive 22 94 - - - - - - Retinal (11-cis) PubChem
small-molecule Inverse agonist - - No No Standfuss J, Xie G, Edwards PC, Burghammer M, Oprian DD, Schertler GF 10.1016/J.JMB.2007.03.007 2007-09-25 No
OPSD Rhodopsin Opsins A Bovine X-ray 2PED - 3.0 B Inactive 22 100 - - - - - - Retinal (9-cis) PubChem
small-molecule Inverse agonist - - No No Nakamichi H, Buss V, Okada T 10.1529/BIOPHYSJ.107.108225 2007-10-30 No
ADRB2 β2 Adrenoceptors A Human X-ray 2RH1 2RH1_refined 2.4 A Inactive 0 68 - - - - T4-Lysozyme - Carazolol PubChem
small-molecule Inverse agonist (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No Cherezov V, Rosenbaum DM, Hanson MA, Rasmussen SG, Thian FS, Kobilka TS, Choi HJ, Kuhn P, Weis WI, Kobilka BK, Stevens RC 10.1126/SCIENCE.1150577 2007-10-30 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 2R4R - 3.4 A Inactive 1 52 - - - - - Antibody - - - (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No Rasmussen SG, Choi HJ, Rosenbaum DM, Kobilka TS, Thian FS, Edwards PC, Burghammer M, Ratnala VR, Sanishvili R, Fischetti RF, Schertler GF, Weis WI, Kobilka BK 10.1038/NATURE06325 2007-11-06 No
ADRB2 β2 Adrenoceptors A Human X-ray 2R4S - 3.4 A Inactive 1 52 - - - - - Antibody - - - (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No - - 2007-11-06 No
OPSD Rhodopsin Opsins A Japanese flying squid X-ray 2ZIY - 3.7 A Inactive 13 83 - - - - - - Retinal (11-cis) PubChem
small-molecule Inverse agonist - - Yes No Shimamura T, Hiraki K, Takahashi N, Hori T, Ago H, Masuda K, Takio K, Ishiguro M, Miyano M 10.1074/JBC.C800040200 2008-05-06 No
OPSD Rhodopsin Opsins A Japanese flying squid X-ray 2Z73 2Z73_refined 2.5 A Inactive 13 78 - - - - - - Retinal (11-cis) PubChem
small-molecule Inverse agonist - - Yes No Murakami M, Kouyama T 10.1038/NATURE06925 2008-05-13 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 3D4S 3D4S_refined 2.8 A Inactive 0 67 - - - - T4-Lysozyme - timolol PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central
small-molecule Inverse agonist (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No Hanson MA, Cherezov V, Griffith MT, Roth CB, Jaakola VP, Chien EY, Velasquez J, Kuhn P, Stevens RC 10.1016/J.STR.2008.05.001 2008-06-17 Yes
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 2VT4 - 2.7 B Inactive 0 57 - - - - - - (S)-Cyanopindolol PubChem
small-molecule Antagonist - - Yes No Warne T, Serrano-Vega MJ, Baker JG, Moukhametzianov R, Edwards PC, Henderson R, Leslie AG, Tate CG, Schertler GF 10.1038/NATURE07101 2008-06-24 No
OPSD Rhodopsin Opsins A Bovine X-ray 3CAP - 2.9 A Active 99 94 - - - - - - Apo (no ligand)
none Apo (no ligand) - - No No Park JH, Scheerer P, Hofmann KP, Choe HW, Ernst OP 10.1038/NATURE07063 2008-06-24 No
OPSD Rhodopsin Opsins A Bovine X-ray 3C9L 3C9L_refined 2.7 A Inactive 22 94 - - - - - - Retinal (11-cis) PubChem
small-molecule Inverse agonist - - No No Stenkamp RE 10.1107/S0907444908017162 2008-08-05 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 3C9M 3C9M_refined 3.4 A Inactive 22 94 - - - - - - Retinal (11-cis) PubChem
small-molecule Inverse agonist - - No No Stenkamp RE 10.1107/S0907444908017162 2008-08-05 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 3DQB 3DQB_refined 3.2 A Active 100 94 Gi/o αt1 Only H5 3 - - Apo (no ligand)
none Apo (no ligand) - - No No Scheerer P, Park JH, Hildebrand PW, Kim YJ, Krauss N, Choe HW, Hofmann KP, Ernst OP 10.1038/NATURE07330 2008-09-23 Yes
AA2AR A2A Adenosine A Human X-ray 3EML - 2.6 A Inactive 1 70 - - - - T4-Lysozyme - ZM-241385 PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Antagonist adenosine small-molecule Yes No Jaakola VP, Griffith MT, Hanson MA, Cherezov V, Chien EY, Lane JR, Ijzerman AP, Stevens RC 10.1126/SCIENCE.1164772 2008-10-14 No
ADRB2 β2 Adrenoceptors A Human X-ray 3KJ6 - 3.4 A Inactive 1 54 - - - - - Antibody - - - (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No Bokoch MP, Zou Y, Rasmussen SG, Liu CW, Nygaard R, Rosenbaum DM, Fung JJ, Choi HJ, Thian FS, Kobilka TS, Puglisi JD, Weis WI, Pardo L, Prosser RS, Mueller L, Kobilka BK 10.1038/NATURE08650 2010-02-16 No
ADRB2 β2 Adrenoceptors A Human X-ray 3NY8 3NY8_refined 2.8 A Inactive 0 67 - - - - T4-Lysozyme - CHEMBL1233766 ChEMBL_compound_ids PubChem
small-molecule Inverse agonist (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No Wacker D, Fenalti G, Brown MA, Katritch V, Abagyan R, Cherezov V, Stevens RC 10.1021/JA105108Q 2010-08-11 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 3NY9 3NY9_refined 2.8 A Inactive 0 67 - - - - T4-Lysozyme - CHEMBL1233771 ChEMBL_compound_ids PubChem
small-molecule Inverse agonist (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No Wacker D, Fenalti G, Brown MA, Katritch V, Abagyan R, Cherezov V, Stevens RC 10.1021/JA105108Q 2010-08-11 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 3NYA 3NYA_refined 3.2 A Inactive 0 67 - - - - T4-Lysozyme - CHEMBL1160734 ChEMBL_compound_ids PubChem
small-molecule Antagonist (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No Wacker D, Fenalti G, Brown MA, Katritch V, Abagyan R, Cherezov V, Stevens RC 10.1021/JA105108Q 2010-08-11 Yes
CXCR4 CXCR4 Chemokine A Human X-ray 3ODU 3ODU_refined 2.5 A Inactive 5 83 - - - - T4-Lysozyme - isothiourea-1t PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Antagonist CXCL12ε, CXCL12φ, CXCL12β, CXCL12γ, CXCL12, CXCL12δ, CXCL12α peptide Yes No Wu B, Chien EY, Mol CD, Fenalti G, Liu W, Katritch V, Abagyan R, Brooun A, Wells P, Bi FC, Hamel DJ, Kuhn P, Handel TM, Cherezov V, Stevens RC 10.1126/SCIENCE.1194396 2010-10-27 Yes
CXCR4 CXCR4 Chemokine A Human X-ray 3OE0 3OE0_refined 2.9 A Inactive 5 78 - - - - T4-Lysozyme - CVX15
peptide Antagonist CXCL12ε, CXCL12φ, CXCL12β, CXCL12γ, CXCL12, CXCL12δ, CXCL12α peptide Yes No Wu B, Chien EY, Mol CD, Fenalti G, Liu W, Katritch V, Abagyan R, Brooun A, Wells P, Bi FC, Hamel DJ, Kuhn P, Handel TM, Cherezov V, Stevens RC 10.1126/SCIENCE.1194396 2010-10-27 Yes
CXCR4 CXCR4 Chemokine A Human X-ray 3OE6 - 3.2 A Inactive 5 77 - - - - T4-Lysozyme - isothiourea-1t PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Antagonist CXCL12ε, CXCL12φ, CXCL12β, CXCL12γ, CXCL12, CXCL12δ, CXCL12α peptide Yes No Wu B, Chien EY, Mol CD, Fenalti G, Liu W, Katritch V, Abagyan R, Brooun A, Wells P, Bi FC, Hamel DJ, Kuhn P, Handel TM, Cherezov V, Stevens RC 10.1126/SCIENCE.1194396 2010-10-27 No
CXCR4 CXCR4 Chemokine A Human X-ray 3OE8 - 3.1 A Inactive 5 76 - - - - T4-Lysozyme - isothiourea-1t PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Antagonist CXCL12ε, CXCL12φ, CXCL12β, CXCL12γ, CXCL12, CXCL12δ, CXCL12α peptide Yes No Wu B, Chien EY, Mol CD, Fenalti G, Liu W, Katritch V, Abagyan R, Brooun A, Wells P, Bi FC, Hamel DJ, Kuhn P, Handel TM, Cherezov V, Stevens RC 10.1126/SCIENCE.1194396 2010-10-27 No
CXCR4 CXCR4 Chemokine A Human X-ray 3OE9 - 3.1 A Inactive 5 74 - - - - T4-Lysozyme - isothiourea-1t PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Antagonist CXCL12ε, CXCL12φ, CXCL12β, CXCL12γ, CXCL12, CXCL12δ, CXCL12α peptide Yes No Wu B, Chien EY, Mol CD, Fenalti G, Liu W, Katritch V, Abagyan R, Brooun A, Wells P, Bi FC, Hamel DJ, Kuhn P, Handel TM, Cherezov V, Stevens RC 10.1126/SCIENCE.1194396 2010-10-27 No
DRD3 D3 Dopamine A Human X-ray 3PBL 3PBL_refined 2.9 A Inactive 1 68 - - - - T4-Lysozyme - eticlopride PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Antagonist dopamine small-molecule Yes No Chien EY, Liu W, Zhao Q, Katritch V, Han GW, Hanson MA, Shi L, Newman AH, Javitch JA, Cherezov V, Stevens RC 10.1126/SCIENCE.1197410 2010-11-03 Yes
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 2Y00 2Y00_refined 2.5 B Inactive 0 62 - - - - - - Dobutamine PubChem
small-molecule Agonist (partial) - - Yes No Warne T, Moukhametzianov R, Baker JG, Nehme R, Edwards PC, Leslie AG, Schertler GF, Tate CG 10.1038/NATURE09746 2011-01-12 Yes
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 2Y02 2Y02_refined 2.6 B Inactive 0 62 - - - - - - CARMOTEROL ChEMBL_compound_ids PubChem PubChem
small-molecule Agonist - - Yes No Warne T, Moukhametzianov R, Baker JG, Nehme R, Edwards PC, Leslie AG, Schertler GF, Tate CG 10.1038/NATURE09746 2011-01-12 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 3PDS 3PDS_refined 3.5 A Inactive 0 68 - - - - T4-Lysozyme - FAUC50 PubChem
small-molecule Agonist (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No Rosenbaum DM, Zhang C, Lyons JA, Holl R, Aragao D, Arlow DH, Rasmussen SG, Choi HJ, Devree BT, Sunahara RK, Chae PS, Gellman SH, Dror RO, Shaw DE, Weis WI, Caffrey M, Gmeiner P, Kobilka BK 10.1038/NATURE09665 2011-01-12 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 3PXO - 3.0 A Active 99 94 - - - - - - Retinal (all-trans) PubChem
small-molecule Agonist - - No No Choe HW, Kim YJ, Park JH, Morizumi T, Pai EF, Krauss N, Hofmann KP, Scheerer P, Ernst OP 10.1038/NATURE09789 2011-03-09 No
AA2AR A2A Adenosine A Human X-ray 2YDO 2YDO_refined 3.0 A Active 73 73 - - - - - - adenosine PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central
small-molecule Agonist adenosine small-molecule Yes No Lebon G, Warne T, Edwards PC, Bennett K, Langmead CJ, Leslie AG, Tate CG 10.1038/NATURE10136 2011-05-18 Yes
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 2YCX - 3.3 A Inactive 0 59 - - - - - - (S)-Cyanopindolol PubChem
small-molecule Antagonist - - Yes No Moukhametzianov R, Warne T, Edwards PC, Serrano-Vega MJ, Leslie AG, Tate CG, Schertler GF 10.1073/PNAS.1100185108 2011-06-01 No
HRH1 H1 Histamine A Human X-ray 3RZE 3RZE_refined 3.1 A Inactive 3 55 - - - - T4-Lysozyme - doxepin PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Guide To Pharmacology
small-molecule Antagonist histamine small-molecule Yes No Shimamura T, Shiroishi M, Weyand S, Tsujimoto H, Winter G, Katritch V, Abagyan R, Cherezov V, Liu W, Han GW, Kobayashi T, Stevens RC, Iwata S 10.1038/NATURE10236 2011-06-15 Yes
AA2AR A2A Adenosine A Human X-ray 3PWH - 3.3 A Inactive 1 71 - - - - - - ZM-241385 PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Antagonist adenosine small-molecule Yes No Dore AS, Robertson N, Errey JC, Ng I, Hollenstein K, Tehan B, Hurrell E, Bennett K, Congreve M, Magnani F, Tate CG, Weir M, Marshall FH 10.1016/J.STR.2011.06.014 2011-09-07 No
ACM2 M2 Acetylcholine (muscarinic) A Human X-ray 3UON 3UON_refined 3.0 A Inactive 3 60 - - - - T4-Lysozyme - CHEMBL558910 ChEMBL_compound_ids PubChem
small-molecule Antagonist acetylcholine small-molecule Yes No Haga K, Kruse AC, Asada H, Yurugi-Kobayashi T, Shiroishi M, Zhang C, Weis WI, Okada T, Kobilka BK, Haga T, Kobayashi T 10.1038/NATURE10753 2012-02-01 Yes
S1PR1 S1P1 Lysophospholipid (S1P) A Human X-ray 3V2Y 3V2Y_refined 2.8 A Inactive 1 76 - - - - T4-Lysozyme - W146 PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Antagonist sphingosine 1-phosphate, dihydrosphingosine 1-phosphate, sphingosylphosphorylcholine small-molecule Yes No Hanson MA, Roth CB, Jo E, Griffith MT, Scott FL, Reinhart G, Desale H, Clemons B, Cahalan SM, Schuerer SC, Sanna MG, Han GW, Kuhn P, Rosen H, Stevens RC 10.1126/SCIENCE.1215904 2012-02-15 Yes
OPRK κ Opioid A Human X-ray 4DJH 4DJH_refined 2.9 A Inactive 5 76 - - - - T4-Lysozyme - JDTic PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Antagonist β-endorphin, dynorphin A-(1-13), dynorphin A, big dynorphin, α-neoendorphin, β-neoendorphin, dynorphin A-(1-8), dynorphin B peptide Yes No Wu H, Wacker D, Mileni M, Katritch V, Han GW, Vardy E, Liu W, Thompson AA, Huang XP, Carroll FI, Mascarella SW, Westkaemper RB, Mosier PD, Roth BL, Cherezov V, Stevens RC 10.1038/NATURE10939 2012-03-21 Yes
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 4AMI 4AMI_refined 3.2 A Inactive 0 58 - - - - - - Bucindolol PubChem
small-molecule Agonist - - Yes No Warne T, Edwards PC, Leslie AG, Tate CG 10.1016/J.STR.2012.03.014 2012-05-23 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 4GBR 4GBR_refined 4.0 A Inactive 0 69 - - - - T4-Lysozyme - Carazolol PubChem
small-molecule Inverse agonist (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No Zou Y, Weis WI, Kobilka BK 10.1371/JOURNAL.PONE.0046039 2012-10-24 Yes
5HT1B 5-HT1B 5-Hydroxytryptamine A Human X-ray 4IAR 4IAR_refined 2.7 A Inactive 83 70 - - - - BRIL - ergotamine PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central
small-molecule Agonist tryptamine, 5-hydroxytryptamine, 5-HT-moduline small-molecule Yes No Wang C, Jiang Y, Ma J, Wu H, Wacker D, Katritch V, Han GW, Liu W, Huang XP, Vardy E, McCorvy JD, Gao X, Zhou XE, Melcher K, Zhang C, Bai F, Yang H, Yang L, Jiang H, Roth BL, Cherezov V, Stevens RC, Xu HE 10.1126/SCIENCE.1232807 2013-03-13 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 4BEZ - 3.3 A Active 99 94 - - - - - - Apo (no ligand)
none Apo (no ligand) - - No No Singhal A, Ostermaier MK, Vishnivetskiy SA, Panneels V, Homan KT, Tesmer JJ, Veprintsev D, Deupi X, Gurevich VV, Schertler GF, Standfuss J 10.1038/EMBOR.2013.44 2013-04-24 No
GLR glucagon Glucagon B1 Human X-ray 4L6R 4L6R_refined 3.3 A Inactive 5 61 - - - - BRIL - - - - glucagon peptide No No Siu FY, He M, de Graaf C, Han GW, Yang D, Zhang Z, Zhou C, Xu Q, Wacker D, Joseph JS, Liu W, Lau J, Cherezov V, Katritch V, Wang MW, Stevens RC 10.1038/nature12393 2013-07-24 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 4LDE 4LDE_refined 2.8 A Active 100 69 - - - - T4-Lysozyme Nanobody BI-167107 PubChem
small-molecule Agonist (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No Ring AM, Manglik A, Kruse AC, Enos MD, Weis WI, Garcia KC, Kobilka BK 10.1038/NATURE12572 2013-09-25 Yes
ACM2 M2 Acetylcholine (muscarinic) A Human X-ray 4MQS 4MQS_refined 3.5 A Active 100 59 - - - - - Nanobody iperoxo PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Agonist acetylcholine small-molecule Yes No Kruse AC, Ring AM, Manglik A, Hu J, Hu K, Eitel K, Hubner H, Pardon E, Valant C, Sexton PM, Christopoulos A, Felder CC, Gmeiner P, Steyaert J, Weis WI, Garcia KC, Wess J, Kobilka BK 10.1038/NATURE12735 2013-11-27 Yes
SMO SMO Frizzled F Human X-ray 4N4W 4N4W_refined 2.8 A Inactive 0 44 - - - - BRIL - SANT-1 PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Antagonist - - No No Wang C, Wu H, Evron T, Vardy E, Han GW, Huang XP, Hufeisen SJ, Mangano TJ, Urban DJ, Katritch V, Cherezov V, Caron MG, Roth BL, Stevens RC 10.1038/NCOMMS5355 2014-01-22 Yes
NTR1 NTS1 Neurotensin A Rat X-ray 4BWB - 3.6 A Inactive 2 72 - - - - - - neurotensin PubChem Guide To Pharmacology ChEMBL_compound_ids Guide To Pharmacology Guide To Pharmacology
peptide Agonist neuromedin N, neurotensin peptide Yes No Egloff P, Hillenbrand M, Klenk C, Batyuk A, Heine P, Balada S, Schlinkmann KM, Scott DJ, Schutz M, Pluckthun A 10.1073/PNAS.1317903111 2014-01-29 No
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 4BVN 4BVN_refined 2.1 A Inactive 0 60 - - - - - - (S)-Cyanopindolol PubChem
small-molecule Antagonist - - Yes Yes Miller-Gallacher JL, Nehme R, Warne T, Edwards PC, Schertler GF, Leslie AG, Tate CG 10.1371/JOURNAL.PONE.0092727 2014-04-02 Yes
FFAR1 FFA1 Free fatty acid A Human X-ray 4PHU 4PHU_refined 2.3 A Intermediate 46 90 - - - - T4-Lysozyme - fasiglifam PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Agonist oleic acid, myristic acid, docosahexaenoic acid, α-linolenic acid small-molecule No No Srivastava A, Yano J, Hirozane Y, Kefala G, Gruswitz F, Snell G, Lane W, Ivetac A, Aertgeerts K, Nguyen J, Jennings A, Okada K 10.1038/NATURE13494 2014-07-16 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 4PXF 4PXF_refined 2.8 A Active 100 93 Visual S-arrestin Fragment 2 - - B-Octylglucoside PubChem
small-molecule unknown - - No No Szczepek M, Beyriere F, Hofmann KP, Elgeti M, Kazmin R, Rose A, Bartl FJ, von Stetten D, Heck M, Sommer ME, Hildebrand PW, Scheerer P 10.1038/NCOMMS5801 2014-09-17 Yes
OPRD δ Opioid A Human X-ray 4RWA 4RWA_refined 3.3 A Inactive 5 77 - - - - BRIL - DIPP-NH2
peptide Antagonist β-endorphin, dynorphin A-(1-13), dynorphin A, endomorphin-1, [Leu]enkephalin, dynorphin A-(1-8), dynorphin B peptide Yes No Fenalti G, Zatsepin NA, Betti C, Giguere P, Han GW, Ishchenko A, Liu W, Guillemyn K, Zhang H, James D, Wang D, Weierstall U, Spence JC, Boutet S, Messerschmidt M, Williams GJ, Gati C, Yefanov OM, White TA, Oberthuer D, Metz M, Yoon CH, Barty A, Chapman HN, Basu S, Coe J, Conrad CE, Fromme R, Fromme P, Tourwe D, Schiller PW, Roth BL, Ballet S, Katritch V, Stevens RC, Cherezov V 10.1038/NSMB.2965 2015-01-14 Yes
US28 US28 Unclassified A strain AD169 X-ray 4XT1 4XT1_refined 2.9 A Active 100 82 - - - - - Nanobody CX3CL1 Guide To Pharmacology
peptide Agonist (partial) - - Yes No Burg JS, Ingram JR, Venkatakrishnan AJ, Jude KM, Dukkipati A, Feinberg EN, Angelini A, Waghray D, Dror RO, Ploegh HL, Garcia KC 10.1126/SCIENCE.AAA5026 2015-03-04 Yes
AGTR1 AT1 Angiotensin A Human X-ray 4YAY 4YAY_refined 2.9 A Inactive 5 79 - - - - BRIL - ZD-7155 PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Antagonist angiotensin IV, angiotensin A, angiotensin II, angiotensin III peptide Yes No Zhang H, Unal H, Gati C, Han GW, Liu W, Zatsepin NA, James D, Wang D, Nelson G, Weierstall U, Sawaya MR, Xu Q, Messerschmidt M, Williams GJ, Boutet S, Yefanov OM, White TA, Wang C, Ishchenko A, Tirupula KC, Desnoyer R, Coe J, Conrad CE, Fromme P, Stevens RC, Katritch V, Karnik SS, Cherezov V 10.1016/J.CELL.2015.04.011 2015-04-22 Yes
LPAR1 LPA1 Lysophospholipid (LPA) A Human X-ray 4Z36 4Z36_refined 2.9 A Inactive 1 79 - - - - BRIL - ONO-3080573 PubChem Guide To Pharmacology
small-molecule Antagonist 1-O-Oleoyl-D-glycerol 3-phosphoric acid small-molecule Yes No Chrencik JE, Roth CB, Terakado M, Kurata H, Omi R, Kihara Y, Warshaviak D, Nakade S, Asmar-Rovira G, Mileni M, Mizuno H, Griffith MT, Rodgers C, Han GW, Velasquez J, Chun J, Stevens RC, Hanson MA 10.1016/J.CELL.2015.06.002 2015-06-03 Yes
OPSD Rhodopsin Opsins A Human X-ray 4ZWJ 4ZWJ_refined 3.3 A Active 100 94 Visual S-arrestin - 86 T4-Lysozyme - Apo (no ligand)
none Apo (no ligand) - - No No Kang Y, Zhou XE, Gao X, He Y, Liu W, Ishchenko A, Barty A, White TA, Yefanov O, Han GW, Xu Q, de Waal PW, Ke J, Tan MH, Zhang C, Moeller A, West GM, Pascal BD, Van Eps N, Caro LN, Vishnivetskiy SA, Lee RJ, Suino-Powell KM, Gu X, Pal K, Ma J, Zhi X, Boutet S, Williams GJ, Messerschmidt M, Gati C, Zatsepin NA, Wang D, James D, Basu S, Roy-Chowdhury S, Conrad CE, Coe J, Liu H, Lisova S, Kupitz C, Grotjohann I, Fromme R, Jiang Y, Tan M, Yang H, Li J, Wang M, Zheng Z, Li D, Howe N, Zhao Y, Standfuss J, Diederichs K, Dong Y, Potter CS, Carragher B, Caffrey M, Jiang H, Chapman HN, Spence JC, Fromme P, Weierstall U, Ernst OP, Katritch V, Gurevich VV, Griffin PR, Hubbell WL, Stevens RC, Cherezov V, Melcher K, Xu HE 10.1038/NATURE14656 2015-07-29 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 4X1H 4X1H_refined 2.3 A Active 100 94 Gi/o αt1 Only H5 3 - - B-Nonylglucoside PubChem
small-molecule unknown - - No No Blankenship E, Vahedi-Faridi A, Lodowski DT 10.1016/J.STR.2015.09.015 2015-11-04 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 5D5B 5D5B_refined 3.8 A Inactive 0 68 - - - - T4-Lysozyme - Carazolol PubChem
small-molecule Inverse agonist (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No Huang CY, Olieric V, Ma P, Howe N, Vogeley L, Liu X, Warshamanage R, Weinert T, Panepucci E, Kobilka B, Diederichs K, Wang M, Caffrey M 10.1107/S2059798315021683 2016-01-13 Yes
OPSD Rhodopsin Opsins A Human X-ray 5DGY 5DGY_refined 7.7 A Active 100 94 Visual S-arrestin - 86 T4-Lysozyme - Apo (no ligand)
none Apo (no ligand) - - No No Zhou XE, Gao X, Barty A, Kang Y, He Y, Liu W, Ishchenko A, White TA, Yefanov O, Han GW, Xu Q, de Waal PW, Suino-Powell KM, Boutet S, Williams GJ, Wang M, Li D, Caffrey M, Chapman HN, Spence JC, Fromme P, Weierstall U, Stevens RC, Cherezov V, Melcher K, Xu HE 10.1038/SDATA.2016.21 2016-03-23 Yes
AA2AR A2A Adenosine A Human X-ray 5IUA 5IUA_refined 2.2 A Inactive 1 72 - - - - BRIL - 2-(Furan-2-yl)-5-N-[3-(4-phenylpiperazin-1-yl)propyl]-1H-[1,2,4]triazolo[1,5-a][1,3,5]triazin-8-ium-5,7-diamine PubChem
small-molecule Antagonist adenosine small-molecule Yes Yes Segala E, Guo D, Cheng RK, Bortolato A, Deflorian F, Doré AS, Errey JC, Heitman LH, IJzerman AP, Marshall FH, Cooke RM. 10.1021/acs.jmedchem.6b00653 2016-06-29 Yes
SMO SMO Frizzled F Human X-ray 5L7I 5L7I_refined 3.3 B Inactive 4 59 - - - - BRIL - vismodegib PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central
small-molecule Antagonist - - No No Byrne EFX, Sircar R, Miller PS, Hedger G, Luchetti G, Nachtergaele S, Tully MD, Mydock-McGrane L, Covey DF, Rambo RP, Sansom MSP, Newstead S, Rohatgi R, Siebold C 10.1038/NATURE18934 2016-07-20 Yes
EDNRB ETB Endothelin A Human X-ray 5GLI 5GLI_refined 2.5 A Inactive 4 71 - - - - T4-Lysozyme - Apo (no ligand)
none Apo (no ligand) endothelin-2, endothelin-1, endothelin-3 peptide Yes No Shihoya W, Nishizawa T, Okuta A, Tani K, Dohmae N, Fujiyoshi Y, Nureki O, Doi T 10.1038/nature19319 2016-09-07 Yes
AA2AR A2A Adenosine A Human X-ray 5K2C 5K2C_refined 1.9 A Inactive 1 72 - - - - BRIL - ZM-241385 PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Antagonist adenosine small-molecule Yes Yes Batyuk A, Galli L, Ishchenko A, Han GW, Gati C, Popov PA, Lee MY, Stauch B, White TA, Barty A, Aquila A, Hunter MS, Liang M, Boutet S, Pu M, Liu ZJ, Nelson G, James D, Li C, Zhao Y, Spence JC, Liu W, Fromme P, Katritch V, Weierstall U, Stevens RC, Cherezov V 10.1126/SCIADV.1600292 2016-09-21 Yes
CNR1 CB1 Cannabinoid A Human X-ray 5U09 5U09_refined 2.6 A Inactive 8 60 - - - - Glycogen synthase - taranabant PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Inverse agonist 2-arachidonoylglycerol, anandamide small-molecule Yes No Shao Z, Yin J, Chapman K, Grzemska M, Clark L, Wang J, Rosenbaum DM 10.1038/NATURE20613 2016-12-07 Yes
AA2AR A2A Adenosine A Human X-ray 5UIG 5UIG_refined 3.5 A Inactive 16 70 - - - - BRIL - 5-Amino-N-[(2-Methoxyphenyl)methyl]-2-(3-Methylphenyl)-2h-1,2,3-Triazole-4-Carboximidamide PubChem
small-molecule Antagonist adenosine small-molecule Yes No Sun B, Bachhawat P, Chu ML, Wood M, Ceska T, Sands ZA, Mercier J, Lebon F, Kobilka TS, Kobilka BK 10.1073/PNAS.1621423114 2017-02-08 Yes
AGTR2 AT2 Angiotensin A Human X-ray 5UNF 5UNF_refined 2.8 A Active 99 79 - - - - BRIL - compound 1 [PMID: 28379944] PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Antagonist angiotensin-(1-7), angiotensin II, angiotensin III peptide Yes No Zhang H, Han GW, Batyuk A, Ishchenko A, White KL, Patel N, Sadybekov A, Zamlynny B, Rudd MT, Hollenstein K, Tolstikova A, White TA, Hunter MS, Weierstall U, Liu W, Babaoglu K, Moore EL, Katz RD, Shipman JM, Garcia-Calvo M, Sharma S, Sheth P, Soisson SM, Stevens RC, Katritch V, Cherezov V 10.1038/NATURE22035 2017-04-05 Yes
PAR2 PAR2 Proteinase-activated A Human X-ray 5NDZ 5NDZ_refined 3.6 A Intermediate 36 74 - - - - BRIL - AZ3451 PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Allosteric antagonist - - Yes Yes Cheng RKY, Fiez-Vandal C, Schlenker O, Edman K, Aggeler B, Brown DG, Brown GA, Cooke RM, Dumelin CE, Dore AS, Geschwindner S, Grebner C, Hermansson NO, Jazayeri A, Johansson P, Leong L, Prihandoko R, Rappas M, Soutter H, Snijder A, Sundstrom L, Tehan B, Thornton P, Troast D, Wiggin G, Zhukov A, Marshall FH, Dekker N 10.1038/NATURE22309 2017-05-03 Yes
AA2AR A2A Adenosine A Human X-ray 5UVI 5UVI_refined 3.2 A Inactive 1 72 - - - - BRIL - ZM-241385 PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Antagonist adenosine small-molecule Yes No Martin-Garcia JM, Conrad CE, Nelson G, Stander N, Zatsepin NA, Zook J, Zhu L, Geiger J, Chun E, Kissick D, Hilgart MC, Ogata C, Ishchenko A, Nagaratnam N, Roy-Chowdhury S, Coe J, Subramanian G, Schaffer A, James D, Ketwala G, Venugopalan N, Xu S, Corcoran S, Ferguson D, Weierstall U, Spence JCH, Cherezov V, Fromme P, Fischetti RF, Liu W 10.1107/S205225251700570X 2017-05-24 Yes
GLP1R GLP-1 Glucagon B1 Human X-ray 5VEW 5VEW_refined 2.7 A Inactive 0 57 - - - - T4-Lysozyme - PF-06372222 PubChem
small-molecule NAM glucagon-like peptide 1-(7-36) amide, glucagon, glucagon-like peptide 1-(7-37) peptide No No Song G, Yang D, Wang Y, de Graaf C, Zhou Q, Jiang S, Liu K, Cai X, Dai A, Lin G, Liu D, Wu F, Wu Y, Zhao S, Ye L, Han GW, Lau J, Wu B, Hanson MA, Liu ZJ, Wang MW, Stevens RC 10.1038/NATURE22378 2017-05-24 Yes
GLR glucagon Glucagon B1 Human X-ray 5XF1 5XF1_refined 3.2 B Inactive 0 81 - - - - T4-Lysozyme Antibody NNC0640 PubChem Guide To Pharmacology
small-molecule NAM glucagon peptide No No Zhang H, Qiao A, Yang D, Yang L, Dai A, de Graaf C, Reedtz-Runge S, Dharmarajan V, Zhang H, Han GW, Grant TD, Sierra RG, Weierstall U, Nelson G, Liu W, Wu Y, Ma L, Cai X, Lin G, Wu X, Geng Z, Dong Y, Song G, Griffin PR, Lau J, Cherezov V, Yang H, Hanson MA, Stevens RC, Zhao Q, Jiang H, Wang MW, Wu B 10.1038/NATURE22363 2017-05-24 Yes
GLP1R GLP-1 Glucagon B1 Human X-ray 5NX2 5NX2_refined 3.7 A Intermediate 31 84 - - - - - - Truncated protein agonist
peptide Agonist glucagon-like peptide 1-(7-36) amide, glucagon, glucagon-like peptide 1-(7-37) peptide No No Jazayeri A, Rappas M, Brown AJH, Kean J, Errey JC, Robertson NJ, Fiez-Vandal C, Andrews SP, Congreve M, Bortolato A, Mason JS, Baig AH, Teobald I, Dore AS, Weir M, Cooke RM, Marshall FH 10.1038/NATURE22800 2017-06-14 Yes
AA2AR A2A Adenosine A Human X-ray 5MZJ 5MZJ_refined 2.0 A Inactive 1 71 - - - - BRIL - theophylline PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central
small-molecule Antagonist adenosine small-molecule Yes Yes Cheng RKY, Segala E, Robertson N, Deflorian F, Dore AS, Errey JC, Fiez-Vandal C, Marshall FH, Cooke RM 10.1016/j.str.2017.06.012 2017-07-26 Yes
5HT2B 5-HT2B 5-Hydroxytryptamine A Human X-ray 5TUD 5TUD_refined 3.0 D Active 92 58 - - - - BRIL Antibody ergotamine PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central
small-molecule Agonist 5-hydroxytryptamine small-molecule Yes No Ishchenko A, Wacker D, Kapoor M, Zhang A, Han GW, Basu S, Patel N, Messerschmidt M, Weierstall U, Liu W, Katritch V, Roth BL, Stevens RC, Cherezov V 10.1073/PNAS.1700891114 2017-07-26 Yes
EDNRB ETB Endothelin A Human X-ray 5XPR 5XPR_refined 3.6 A Inactive 4 69 - - - - T4-Lysozyme - Apo (no ligand)
none Apo (no ligand) endothelin-2, endothelin-1, endothelin-3 peptide Yes No Shihoya W, Nishizawa T, Yamashita K, Inoue A, Hirata K, Kadji FMN, Okuta A, Tani K, Aoki J, Fujiyoshi Y, Doi T, Nureki O 10.1038/NSMB.3450 2017-08-16 Yes
AA2AR A2A Adenosine A Human X-ray 5NM2 5NM2_refined 2.0 A Inactive 1 72 - - - - BRIL - ZM-241385 PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Antagonist adenosine small-molecule Yes Yes Weinert T, Olieric N, Cheng R, Brunle S, James D, Ozerov D, Gashi D, Vera L, Marsh M, Jaeger K, Dworkowski F, Panepucci E, Basu S, Skopintsev P, Dore AS, Geng T, Cooke RM, Liang M, Prota AE, Panneels V, Nogly P, Ermler U, Schertler G, Hennig M, Steinmetz MO, Wang M, Standfuss J 10.1038/S41467-017-00630-4 2017-09-27 Yes
AA2AR A2A Adenosine A Human X-ray 5VRA 5VRA_refined 2.4 A Inactive 1 72 - - - - BRIL - ZM-241385 PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Antagonist adenosine small-molecule Yes Yes Broecker J, Morizumi T, Ou WL, Klingel V, Kuo A, Kissick DJ, Ishchenko A, Lee MY, Xu S, Makarov O, Cherezov V, Ogata CM, Ernst OP 10.1038/NPROT.2017.135 2017-12-13 Yes
AA2AR A2A Adenosine A Human X-ray 6AQF 6AQF_refined 2.5 A Inactive 1 72 - - - - BRIL - ZM-241385 PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Antagonist adenosine small-molecule Yes No Eddy MT, Lee MY, Gao ZG, White KL, Didenko T, Horst R, Audet M, Stanczak P, McClary KM, Han GW, Jacobson KA, Stevens RC, Wuthrich K 10.1016/J.CELL.2017.12.004 2018-01-10 Yes
AA2AR A2A Adenosine A Human X-ray 5OLV 5OLV_refined 2.0 A Inactive 1 72 - - - - BRIL - CHEMBL1671936 ChEMBL_compound_ids PubChem
small-molecule Antagonist adenosine small-molecule Yes Yes Rucktooa P, Cheng RKY, Segala E, Geng T, Errey JC, Brown GA, Cooke RM, Marshall FH, Dore AS 10.1038/S41598-017-18570-W 2018-01-17 Yes
GLR glucagon Glucagon B1 Human X-ray 5YQZ 5YQZ_refined 3.0 R Inactive 3 83 - - - - T4-Lysozyme - NNC1702 Guide To Pharmacology
peptide Agonist (partial) glucagon peptide No No Zhang H, Qiao A, Yang L, Van Eps N, Frederiksen KS, Yang D, Dai A, Cai X, Zhang H, Yi C, Cao C, He L, Yang H, Lau J, Ernst OP, Hanson MA, Stevens RC, Wang MW, Reedtz-Runge S, Jiang H, Zhao Q, Wu B 10.1038/NATURE25153 2018-01-17 Yes
AA2AR A2A Adenosine A Human X-ray 5WF6 5WF6_refined 2.9 A Active 73 68 - - - - T4-Lysozyme - UK-432,097 PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Agonist adenosine small-molecule No No White KL, Eddy MT, Gao ZG, Han GW, Lian T, Deary A, Patel N, Jacobson KA, Katritch V, Stevens RC 10.1016/J.STR.2017.12.013 2018-02-21 Yes
DRD2 D2 Dopamine A Human X-ray 6CM4 6CM4_refined 2.9 A Inactive 1 59 - - - - T4-Lysozyme - risperidone PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central
small-molecule Inverse agonist dopamine small-molecule Yes No Wang S, Che T, Levit A, Shoichet BK, Wacker D, Roth BL 10.1038/NATURE25758 2018-03-14 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 6FK8 6FK8_refined 2.9 A Active 99 94 - - - - - - (2~{R},3~{S})-3-azanyl-2-(4-chlorophenyl)-1-spiro[1,3-benzodioxole-2,4'-piperidine]-1'-yl-butan-1-one PubChem
small-molecule Agonist - - No No Mattle D, Kuhn B, Aebi J, Bedoucha M, Kekilli D, Grozinger N, Alker A, Rudolph MG, Schmid G, Schertler GFX, Hennig M, Standfuss J, Dawson RJP 10.1073/PNAS.1718084115 2018-04-04 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 6FKC 6FKC_refined 2.5 A Active 99 94 - - - - - - 3-[1'-[(2~{S})-2-(4-chlorophenyl)-3-methyl-butanoyl]spiro[1,3-benzodioxole-2,4'-piperidine]-5-yl]propanoic acid PubChem
small-molecule Agonist - - No No Mattle D, Kuhn B, Aebi J, Bedoucha M, Kekilli D, Grozinger N, Alker A, Rudolph MG, Schmid G, Schertler GFX, Hennig M, Standfuss J, Dawson RJP 10.1073/PNAS.1718084115 2018-04-04 Yes
FFAR1 FFA1 Free fatty acid A Human X-ray 5KW2 5KW2_refined 2.8 A Intermediate 46 82 - - - - T4-Lysozyme - (3~{S})-3-cyclopropyl-3-[2-[1-[2-[2,2-dimethylpropyl-(6-methylpyridin-2-yl)carbamoyl]-5-methoxy-phenyl]piperidin-4-yl]-1-benzofuran-6-yl]propanoic acid PubChem
small-molecule Allosteric agonist oleic acid, myristic acid, docosahexaenoic acid, α-linolenic acid small-molecule No No Ho JD, Chau B, Rodgers L, Lu F, Wilbur KL, Otto KA, Chen Y, Song M, Riley JP, Yang HC, Reynolds NA, Kahl SD, Lewis AP, Groshong C, Madsen RE, Conners K, Lineswala JP, Gheyi T, Saflor MD, Lee MR, Benach J, Baker KA, Montrose-Rafizadeh C, Genin MJ, Miller AR, Hamdouchi C 10.1038/S41467-017-01240-W 2018-05-02 Yes
Q98SW5 SMO Frizzled F African clawed frog X-ray 6D35 6D35_refined 3.9 A Active 87 58 - - - - BRIL - Cholesterol PubChem
small-molecule Agonist - - No No Huang P, Zheng S, Wierbowski BM, Kim Y, Nedelcu D, Aravena L, Liu J, Kruse AC, Salic A 10.1016/J.CELL.2018.04.029 2018-05-23 Yes
OPRM μ Opioid A Mouse cryo-EM 6DDE 6DDE_refined 3.5 R Active 100 71 Gi/o αi1 - 61 - Antibody DAMGO PubChem Guide To Pharmacology ChEMBL_compound_ids ChEMBL_compound_ids
peptide Agonist - - Yes No Koehl A, Hu H, Maeda S, Zhang Y, Qu Q, Paggi JM, Latorraca NR, Hilger D, Dawson R, Matile H, Schertler GFX, Granier S, Weis WI, Dror RO, Manglik A, Skiniotis G, Kobilka BK 10.1038/S41586-018-0219-7 2018-06-13 Yes
PTAFR PAF Platelet-activating factor A Human X-ray 5ZKQ 5ZKQ_refined 2.9 B Intermediate 36 83 - - - - T4-Lysozyme - ABT-491 PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Inverse agonist PAF, methylcarbamyl PAF small-molecule Yes No Cao C, Tan Q, Xu C, He L, Yang L, Zhou Y, Zhou Y, Qiao A, Lu M, Yi C, Han GW, Wang X, Li X, Yang H, Rao Z, Jiang H, Zhao Y, Liu J, Stevens RC, Zhao Q, Zhang XC, Wu B 10.1038/S41594-018-0068-Y 2018-06-20 Yes
AGTR2 AT2 Angiotensin A Human X-ray 5XJM 5XJM_refined 3.2 A Active 99 78 - - - - BRIL Fab CHEMBL404594 ChEMBL_compound_ids PubChem
protein Agonist angiotensin-(1-7), angiotensin II, angiotensin III peptide Yes No Asada H, Horita S, Hirata K, Shiroishi M, Shiimura Y, Iwanari H, Hamakubo T, Shimamura T, Nomura N, Kusano-Arai O, Uemura T, Suno C, Kobayashi T, Iwata S 10.1038/S41594-018-0079-8 2018-07-11 Yes
5HT2B 5-HT2B 5-Hydroxytryptamine A Human X-ray 6DRZ 6DRZ_refined 3.1 A Intermediate 36 61 - - - - BRIL - methysergide PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central
small-molecule Antagonist 5-hydroxytryptamine small-molecule Yes No McCorvy JD, Wacker D, Wang S, Agegnehu B, Liu J, Lansu K, Tribo AR, Olsen RHJ, Che T, Jin J, Roth BL 10.1038/s41594-018-0116-7 2018-08-29 Yes
PD2R2 DP2 Prostanoid A Human X-ray 6D27 6D27_refined 2.7 A Inactive 19 81 - - - - T4-Lysozyme - CHEMBL179036 ChEMBL_compound_ids PubChem
small-molecule Antagonist PGF2α, PGE2, PGJ2, thromboxane A2, PGD3, PGD2, PGI2 small-molecule Yes No Wang L, Yao D, Deepak RNVK, Liu H, Xiao Q, Fan H, Gong W, Wei Z, Zhang C 10.1016/J.MOLCEL.2018.08.009 2018-10-03 Yes
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 6H7L 6H7L_refined 2.7 A Active 100 60 - - - - Thioredoxin 1 Camelid antibody fragment Nb6B9 Dobutamine PubChem
small-molecule Agonist - - Yes No Warne T, Edwards PC, Dore AS, Leslie AGW, Tate CG 10.1126/SCIENCE.AAU5595 2018-10-17 Yes
CCR5 CCR5 Chemokine A Human X-ray 6AKX 6AKX_refined 2.8 B Inactive 12 82 - - - - Rubredoxin - N-[(1S)-3-{(3-exo)-3-[3-methyl-5-(propan-2-yl)-4H-1,2,4-triazol-4-yl]-8-azabicyclo[3.2.1]octan-8-yl}-1-(thiophen-2-yl)propyl]cyclopentanecarboxamide PubChem
small-molecule Antagonist CCL3, CCL16, CCL4, CCL11, CCL14, CCL13, CCL2, CCL7, CCL5, CCL8 peptide No No Peng P, Chen H, Zhu Y, Wang Z, Li J, Luo RH, Wang J, Chen L, Yang LM, Jiang H, Xie X, Wu B, Zheng YT, Liu H. 10.1021/acs.jmedchem.8b01077 2018-10-24 Yes
ACM2 M2 Acetylcholine (muscarinic) A Human X-ray 5ZK3 5ZK3_refined 2.6 A Inactive 3 59 - - - - BRIL - CHEMBL558910 ChEMBL_compound_ids PubChem
small-molecule Antagonist acetylcholine small-molecule No No Suno R, Lee S, Maeda S, Yasuda S, Yamashita K, Hirata K, Horita S, Tawaramoto MS, Tsujimoto H, Murata T, Kinoshita M, Yamamoto M, Kobilka BK, Vaidehi N, Iwata S, Kobayashi T 10.1038/S41589-018-0152-Y 2018-11-21 Yes
ACM2 M2 Acetylcholine (muscarinic) A Human X-ray 5ZKC 5ZKC_refined 2.3 A Inactive 3 60 - - - - BRIL - N-methyl scopolamine PubChem Guide To Pharmacology DrugBank Guide To Pharmacology
small-molecule Antagonist acetylcholine small-molecule No No Suno R, Lee S, Maeda S, Yasuda S, Yamashita K, Hirata K, Horita S, Tawaramoto MS, Tsujimoto H, Murata T, Kinoshita M, Yamamoto M, Kobilka BK, Vaidehi N, Iwata S, Kobayashi T 10.1038/S41589-018-0152-Y 2018-11-21 Yes
ACM3 M3 Acetylcholine (muscarinic) A Rat X-ray 5ZHP 5ZHP_refined 3.1 B Inactive 3 47 - - - - T4-Lysozyme - (1R,2R,4S,5S,7s)-7-({[4-fluoro-2-(thiophen-2-yl)phenyl]carbamoyl}oxy)-9,9-dimethyl-3-oxa-9-azatricyclo[3.3.1.0~2,4~]nonan-9-ium PubChem
small-molecule Antagonist acetylcholine small-molecule No No Liu H, Hofmann J, Fish I, Schaake B, Eitel K, Bartuschat A, Kaindl J, Rampp H, Banerjee A, Hubner H, Clark MJ, Vincent SG, Fisher JT, Heinrich MR, Hirata K, Liu X, Sunahara RK, Shoichet BK, Kobilka BK, Gmeiner P 10.1073/PNAS.1813988115 2018-11-28 Yes
PE2R3 EP3 Prostanoid A Human X-ray 6M9T 6M9T_refined 2.5 A Active 83 70 - - - - T4-Lysozyme - Misoprostol-FA PubChem
small-molecule Agonist PGE1, PGF2α, PGE2, thromboxane A2, PGD2, PGI2 small-molecule Yes No Audet M, White KL, Breton B, Zarzycka B, Han GW, Lu Y, Gati C, Batyuk A, Popov P, Velasquez J, Manahan D, Hu H, Weierstall U, Liu W, Shui W, Katritch V, Cherezov V, Hanson MA, Stevens RC 10.1038/S41589-018-0160-Y 2018-12-05 Yes
TA2R TP Prostanoid A Human X-ray 6IIU 6IIU_refined 2.5 A Intermediate 46 87 - - - - Rubredoxin - ramatroban PubChem Guide To Pharmacology ChEMBL_compound_ids Drug Central DrugBank Guide To Pharmacology
small-molecule Antagonist PGF2α, PGE2, PGI2, PGH2, PGD2, thromboxane A2 small-molecule No No Fan H, Chen S, Yuan X, Han S, Zhang H, Xia W, Xu Y, Zhao Q, Wu B 10.1038/S41589-018-0170-9 2018-12-19 Yes
CCR2 CCR2 Chemokine A Human X-ray 6GPS 6GPS_refined 3.3 A Inactive 12 74 - - - - Rubredoxin - MK-0812 PubChem
small-molecule Antagonist CCL16, CCL11, CCL26, CCL13, CCL24, CCL2, CCL7, CCL8 peptide No No Apel AK, Cheng RKY, Tautermann CS, Brauchle M, Huang CY, Pautsch A, Hennig M, Nar H, Schnapp G 10.1016/J.STR.2018.10.027 2019-01-02 Yes
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 6IBL 6IBL_refined 2.7 A Active 100 60 - - - - Thioredoxin 1 Camelid antibody fragment Nb80 arformoterol PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central
small-molecule Agonist - - Yes No - 10.1101/436212 2019-01-09 Yes
NK1R NK1 Tachykinin A Human X-ray 6HLO 6HLO_refined 2.4 A Inactive 1 70 - - - - GlgA glycogen synthase - aprepitant PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central PubChem
small-molecule Antagonist neurokinin B, neuropeptide K, substance P, hemokinin 1, neuropeptide-γ, neurokinin A peptide Yes No Schoppe J, Ehrenmann J, Klenk C, Rucktooa P, Schutz M, Dore AS, Pluckthun A 10.1038/S41467-018-07939-8 2019-01-16 Yes
GRM5 mGlu5 Metabotropic glutamate C Human cryo-EM 6N51 6N51_refined 4.0 B Intermediate 45 65 - - - - - Nanobody-43 quisqualate PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Guide To Pharmacology PubChem
small-molecule Agonist L-glutamic acid small-molecule No No Koehl A, Hu H, Feng D, Sun B, Zhang Y, Robertson MJ, Chu M, Kobilka TS, Laeremans T, Steyaert J, Tarrasch J, Dutta S, Fonseca R, Weis WI, Mathiesen JM, Skiniotis G, Kobilka BK 10.1038/S41586-019-0881-4 2019-01-23 Yes
CALCR CT Calcitonin B1 Human cryo-EM 6NIY 6NIY_refined 3.3 R Active 100 55 Gs αs - 43 - - Calcitonin salmon PubChem
peptide Agonist amylin, α-CGRP, adrenomedullin, adrenomedullin 2/intermedin, β-CGRP, calcitonin (salmon), calcitonin peptide No No Dal Maso E, Glukhova A, Zhu Y, Garcia-Nafria J, Tate CG, Atanasio S, Reynolds CA, Ramirez-Aportela E, Carazo JM, Hick CA, Furness SGB, Hay DL, Liang YL, Miller LJ, Christopoulos A, Wang MW, Wootten D, Sexton PM 10.1021/ACSPTSCI.8B00056 2019-01-23 Yes
CNR1 CB1 Cannabinoid A Human cryo-EM 6N4B 6N4B_refined 3.0 R Active 100 58 Gi/o αi1 - 62 - scFv16 MDMB-Fubinaca PubChem Guide To Pharmacology
small-molecule Agonist 2-arachidonoylglycerol, anandamide small-molecule Yes No Krishna Kumar K, Shalev-Benami M, Robertson MJ, Hu H, Banister SD, Hollingsworth SA, Latorraca NR, Kato HE, Hilger D, Maeda S, Weis WI, Farrens DL, Dror RO, Malhotra SV, Kobilka BK, Skiniotis G 10.1016/J.CELL.2018.11.040 2019-01-30 Yes
5HT2A 5-HT2A 5-Hydroxytryptamine A Human X-ray 6A94 6A94_refined 2.9 A Inactive 1 60 - - - - BRIL - zotepine PubChem Guide To Pharmacology ChEMBL_compound_ids Drug Central DrugBank
small-molecule Antagonist tryptamine, 5-hydroxytryptamine small-molecule No No Kimura KT, Asada H, Inoue A, Kadji FMN, Im D, Mori C, Arakawa T, Hirata K, Nomura Y, Nomura N, Aoki J, Iwata S, Shimamura T 10.1038/S41594-018-0180-Z 2019-02-13 Yes
NK1R NK1 Tachykinin A Human X-ray 6J21 6J21_refined 3.2 A Inactive 1 71 - - - - T4-Lysozyme - aprepitant PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central PubChem
small-molecule Antagonist neurokinin B, neuropeptide K, substance P, hemokinin 1, neuropeptide-γ, neurokinin A peptide Yes No Chen S, Lu M, Liu D, Yang L, Yi C, Ma L, Zhang H, Liu Q, Frimurer TM, Wang MW, Schwartz TW, Stevens RC, Wu B, Wuthrich K, Zhao Q 10.1038/S41467-019-08568-5 2019-03-06 Yes
PTH1R PTH1 Parathyroid hormone B1 Human cryo-EM 6NBH - 3.5 R Active 100 64 Gs αs - 57 - Nanobody-35 Long-acting parathyroid hormone analog
peptide Agonist PTH, PTHrP-(1-36), TIP39, PTHrP peptide No No Zhao LH, Ma S, Sutkeviciute I, Shen DD, Zhou XE, de Waal PW, Li CY, Kang Y, Clark LJ, Jean-Alphonse FG, White AD, Yang D, Dai A, Cai X, Chen J, Li C, Jiang Y, Watanabe T, Gardella TJ, Melcher K, Wang MW, Vilardaga JP, Xu HE, Zhang Y 10.1126/SCIENCE.AAV7942 2019-04-17 Yes
MTR1A MT1 Melatonin A Human X-ray 6ME2 6ME2_refined 2.8 A Inactive 1 83 - - - - GlgA glycogen synthase - ramelteon PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central
small-molecule Agonist melatonin small-molecule No No Stauch B, Johansson LC, McCorvy JD, Patel N, Han GW, Huang XP, Gati C, Batyuk A, Slocum ST, Ishchenko A, Brehm W, White TA, Michaelian N, Madsen C, Zhu L, Grant TD, Grandner JM, Shiriaeva A, Olsen RHJ, Tribo AR, Yous S, Stevens RC, Weierstall U, Katritch V, Roth BL, Liu W, Cherezov V 10.1038/S41586-019-1141-3 2019-04-24 Yes
MTR1A MT1 Melatonin A Human X-ray 6ME3 6ME3_refined 2.9 A Inactive 1 82 - - - - GlgA glycogen synthase - 2-phenylmelatonin PubChem
small-molecule Agonist melatonin small-molecule No No Stauch B, Johansson LC, McCorvy JD, Patel N, Han GW, Huang XP, Gati C, Batyuk A, Slocum ST, Ishchenko A, Brehm W, White TA, Michaelian N, Madsen C, Zhu L, Grant TD, Grandner JM, Shiriaeva A, Olsen RHJ, Tribo AR, Yous S, Stevens RC, Weierstall U, Katritch V, Roth BL, Liu W, Cherezov V 10.1038/S41586-019-1141-3 2019-04-24 Yes
MTR1A MT1 Melatonin A Human X-ray 6ME5 6ME5_refined 3.2 A Inactive 1 83 - - - - GlgA glycogen synthase - agomelatine PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central
small-molecule Agonist melatonin small-molecule No No Stauch B, Johansson LC, McCorvy JD, Patel N, Han GW, Huang XP, Gati C, Batyuk A, Slocum ST, Ishchenko A, Brehm W, White TA, Michaelian N, Madsen C, Zhu L, Grant TD, Grandner JM, Shiriaeva A, Olsen RHJ, Tribo AR, Yous S, Stevens RC, Weierstall U, Katritch V, Roth BL, Liu W, Cherezov V 10.1038/S41586-019-1141-3 2019-04-24 Yes
MTR1B MT2 Melatonin A Human X-ray 6ME7 6ME7_refined 3.2 A Inactive 1 79 - - - - Rubredoxin - 2-phenylmelatonin PubChem
small-molecule Agonist melatonin small-molecule No No Johansson LC, Stauch B, McCorvy JD, Han GW, Patel N, Huang XP, Batyuk A, Gati C, Slocum ST, Li C, Grandner JM, Hao S, Olsen RHJ, Tribo AR, Zaare S, Zhu L, Zatsepin NA, Weierstall U, Yous S, Stevens RC, Liu W, Roth BL, Katritch V, Cherezov V 10.1038/S41586-019-1144-0 2019-04-24 Yes
MTR1B MT2 Melatonin A Human X-ray 6ME9 6ME9_refined 3.3 B Inactive 1 79 - - - - Rubredoxin - ramelteon PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central
small-molecule Agonist melatonin small-molecule No No Johansson LC, Stauch B, McCorvy JD, Han GW, Patel N, Huang XP, Batyuk A, Gati C, Slocum ST, Li C, Grandner JM, Hao S, Olsen RHJ, Tribo AR, Zaare S, Zhu L, Zatsepin NA, Weierstall U, Yous S, Stevens RC, Liu W, Roth BL, Katritch V, Cherezov V 10.1038/S41586-019-1144-0 2019-04-24 Yes
ACM1 M1 Acetylcholine (muscarinic) A Human cryo-EM 6OIJ 6OIJ_refined 3.3 R Active 100 64 Gq/11 α11 - 63 - Antibody fragment iperoxo PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Agonist acetylcholine small-molecule Yes No Maeda S, Qu Q, Robertson MJ, Skiniotis G, Kobilka BK 10.1126/SCIENCE.AAW5188 2019-05-08 Yes
SMO SMO Frizzled F Human cryo-EM 6OT0 - 3.9 R Active 100 46 Gi/o αi1 - 100 - Fab light chain
Fab heavy chain		 24,25-Epoxy-cholesterol PubChem
small-molecule Agonist - - No No Qi X, Liu H, Thompson B, McDonald J, Zhang C, Li X 10.1038/S41586-019-1286-0 2019-06-12 Yes
OPSD Rhodopsin Opsins A Bovine cryo-EM 6QNO 6QNO_refined 4.4 R Active 100 96 Gi/o αi1 - 60 - Fab antibody fragment light chain
Fab antibody fragment heavy chain		 Retinal (all-trans) PubChem
small-molecule Agonist - - No No Tsai CJ, Marino J, Adaixo R, Pamula F, Muehle J, Maeda S, Flock T, Taylor NM, Mohammed I, Matile H, Dawson RJ, Deupi X, Stahlberg H, Schertler G 10.7554/ELIFE.46041 2019-07-10 Yes
SUCR1 succinate Succinate A Rat X-ray 6IBB 6IBB_refined 2.1 A Intermediate 36 93 - - - - - Nanobody-6 - - - - - Yes No Haffke M, Fehlmann D, Rummel G, Boivineau J, Duckely M, Gommermann N, Cotesta S, Sirockin F, Freuler F, Littlewood-Evans A, Kaupmann K, Jaakola VP 10.1038/S41586-019-1663-8 2019-08-14 Yes
CNR1 CB1 Cannabinoid A Human X-ray 6KQI 6KQI_refined 3.3 A Inactive 8 60 - - - - GlgA glycogen synthase - CP55940 PubChem Guide To Pharmacology ChEMBL_compound_ids Guide To Pharmacology
Org27569 PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule
small-molecule		 Agonist
NAM		 2-arachidonoylglycerol, anandamide small-molecule No No Shao Z, Yan W, Chapman K, Ramesh K, Ferrell AJ, Yin J, Wang X, Xu Q, Rosenbaum DM 10.1038/S41589-019-0387-2 2019-10-23 Yes
GLP1R GLP-1 Glucagon B1 Human X-ray 6KJV 6KJV_refined 2.8 B Inactive 0 57 - - - - T4-Lysozyme - PF-06372222 PubChem
small-molecule NAM glucagon-like peptide 1-(7-36) amide, glucagon, glucagon-like peptide 1-(7-37) peptide No No Xu Y, Wang Y, Wang Y, Liu K, Peng Y, Yao D, Tao H, Liu H, Song G 10.1107/S2052252519013496 2019-11-13 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 6PS0 6PS0_refined 3.4 A Inactive 0 68 - - - - T4-Lysozyme - carazolol PubChem Guide To Pharmacology ChEMBL_compound_ids Drug Central
small-molecule Antagonist (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No Ishchenko A, Stauch B, Han GW, Batyuk A, Shiriaeva A, Li C, Zatsepin N, Weierstall U, Liu W, Nango E, Nakane T, Tanaka R, Tono K, Joti Y, Iwata S, Moraes I, Gati C, Cherezov V 10.1107/S2052252519013137 2019-11-13 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 6PS4 6PS4_refined 2.6 A Inactive 0 68 - - - - T4-Lysozyme - CHEMBL1233766 ChEMBL_compound_ids PubChem
small-molecule Antagonist (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No Ishchenko A, Stauch B, Han GW, Batyuk A, Shiriaeva A, Li C, Zatsepin N, Weierstall U, Liu W, Nango E, Nakane T, Tanaka R, Tono K, Joti Y, Iwata S, Moraes I, Gati C, Cherezov V 10.1107/S2052252519013137 2019-11-13 Yes
MTR1A MT1 Melatonin A Human X-ray 6PS8 6PS8_refined 3.3 A Inactive 1 83 - - - - GlgA glycogen synthase - 2-phenylmelatonin PubChem
small-molecule Agonist melatonin small-molecule No No Ishchenko A, Stauch B, Han GW, Batyuk A, Shiriaeva A, Li C, Zatsepin N, Weierstall U, Liu W, Nango E, Nakane T, Tanaka R, Tono K, Joti Y, Iwata S, Moraes I, Gati C, Cherezov V 10.1107/S2052252519013137 2019-11-13 Yes
ADA2C α2C Adrenoceptors A Human X-ray 6KUW 6KUW_refined 2.8 A Inactive 1 60 - - - - GlgA glycogen synthase - (8Ar,12aS,13aR)-12-ethylsulfonyl-3-methoxy-5,6,8,8a,9,10,11,12a,13,13a-decahydroisoquinolino[2,1-g][1,6]naphthyridine PubChem
small-molecule Antagonist (-)-noradrenaline, (-)-adrenaline small-molecule Yes No - - 2019-12-04 Yes
OPRD δ Opioid A Human X-ray 6PT2 6PT2_refined 2.8 A Active 73 78 - - - - BRIL - KGCHM07
peptide Agonist β-endorphin, dynorphin A-(1-13), dynorphin A, endomorphin-1, [Leu]enkephalin, dynorphin A-(1-8), dynorphin B peptide No No Claff T, Yu J, Blais V, Patel N, Martin C, Wu L, Han GW, Holleran BJ, Van der Poorten O, White KL, Hanson MA, Sarret P, Gendron L, Cherezov V, Katritch V, Ballet S, Liu ZJ, Muller CE, Stevens RC 10.1126/SCIADV.AAX9115 2019-12-11 Yes
CLTR2 CysLT2 Leukotriene A Human X-ray 6RZ8 6RZ8_refined 2.7 A Intermediate 36 78 - - - - BRIL - ONO-2080365 PubChem
small-molecule Antagonist LTD4, LTC4, LTE4 small-molecule No No Gusach A, Luginina A, Marin E, Brouillette RL, Besserer-Offroy E, Longpre JM, Ishchenko A, Popov P, Patel N, Fujimoto T, Maruyama T, Stauch B, Ergasheva M, Romanovskaia D, Stepko A, Kovalev K, Shevtsov M, Gordeliy V, Han GW, Katritch V, Borshchevskiy V, Sarret P, Mishin A, Cherezov V 10.1038/S41467-019-13348-2 2019-12-11 Yes
OX1R OX1 Orexin A Human X-ray 6TP3 6TP3_refined 3.0 A Inactive 1 74 - - - - - - daridorexant PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Antagonist orexin-A, orexin-B peptide No No Rappas M, Ali AAE, Bennett KA, Brown JD, Bucknell SJ, Congreve M, Cooke RM, Cseke G, de Graaf C, Doré AS, Errey JC, Jazayeri A, Marshall FH, Mason JS, Mould R, Patel JC, Tehan BG, Weir M, Christopher JA. 10.1021/acs.jmedchem.9b01787 2020-01-01 Yes
OX2R OX2 Orexin A Human X-ray 6TPJ 6TPJ_refined 2.7 A Inactive 1 68 - - - - GlgA glycogen synthase - suvorexant PubChem Guide To Pharmacology ChEMBL_compound_ids Drug Central DrugBank
small-molecule Antagonist orexin-A, orexin-B peptide No No Rappas M, Ali AAE, Bennett KA, Brown JD, Bucknell SJ, Congreve M, Cooke RM, Cseke G, de Graaf C, Doré AS, Errey JC, Jazayeri A, Marshall FH, Mason JS, Mould R, Patel JC, Tehan BG, Weir M, Christopher JA. 10.1021/acs.jmedchem.9b01787 2020-01-01 Yes
OX1R OX1 Orexin A Human X-ray 6TQ9 6TQ9_refined 2.7 B Inactive 1 71 - - - - - - SB-408124 PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Antagonist orexin-A, orexin-B peptide No No Rappas M, Ali AAE, Bennett KA, Brown JD, Bucknell SJ, Congreve M, Cooke RM, Cseke G, de Graaf C, Doré AS, Errey JC, Jazayeri A, Marshall FH, Mason JS, Mould R, Patel JC, Tehan BG, Weir M, Christopher JA. 10.1021/acs.jmedchem.9b01787 2020-01-01 Yes
OX1R OX1 Orexin A Human X-ray 6TOT 6TOT_refined 2.2 B Inactive 1 71 - - - - - - lemborexant PubChem Guide To Pharmacology ChEMBL_compound_ids Drug Central DrugBank
small-molecule Antagonist orexin-A, orexin-B peptide No No Rappas M, Ali AAE, Bennett KA, Brown JD, Bucknell SJ, Congreve M, Cooke RM, Cseke G, de Graaf C, Doré AS, Errey JC, Jazayeri A, Marshall FH, Mason JS, Mould R, Patel JC, Tehan BG, Weir M, Christopher JA. 10.1021/acs.jmedchem.9b01787 2020-01-15 Yes
CNR2 CB2 Cannabinoid A Human X-ray 6KPC 6KPC_refined 3.2 A Inactive 8 79 - - - - T4-Lysozyme - AM841 PubChem Guide To Pharmacology
small-molecule Agonist 2-arachidonoylglycerol, anandamide small-molecule Yes No Hua T, Li X, Wu L, Iliopoulos-Tsoutsouvas C, Wang Y, Wu M, Shen L, Brust CA, Nikas SP, Song F, Song X, Yuan S, Sun Q, Wu Y, Jiang S, Grim TW, Benchama O, Stahl EL, Zvonok N, Zhao S, Bohn LM, Makriyannis A, Liu ZJ 10.1016/J.CELL.2020.01.008 2020-02-12 Yes
CNR2 CB2 Cannabinoid A Human cryo-EM 6KPF 6KPF_refined 2.9 R Active 100 81 Gi/o αi1 - 62 - scFv16 AM841 PubChem Guide To Pharmacology
small-molecule Agonist 2-arachidonoylglycerol, anandamide small-molecule Yes No Hua T, Li X, Wu L, Iliopoulos-Tsoutsouvas C, Wang Y, Wu M, Shen L, Brust CA, Nikas SP, Song F, Song X, Yuan S, Sun Q, Wu Y, Jiang S, Grim TW, Benchama O, Stahl EL, Zvonok N, Zhao S, Bohn LM, Makriyannis A, Liu ZJ 10.1016/J.CELL.2020.01.008 2020-02-12 Yes
CRFR1 CRF1 Corticotropin-releasing factor B1 Human cryo-EM 6PB0 6PB0_refined 3.0 R Active 100 68 Gs αs Gs-Gi1 chimera 58 - Nanobody-35 CHEMBL427807 ChEMBL_compound_ids PubChem
protein Agonist corticotrophin-releasing hormone, urocortin 2, urocortin 1 peptide No No Ma S, Shen Q, Zhao LH, Mao C, Zhou XE, Shen DD, de Waal PW, Bi P, Li C, Jiang Y, Wang MW, Sexton PM, Wootten D, Melcher K, Zhang Y, Xu HE 10.1016/J.MOLCEL.2020.01.013 2020-02-12 Yes
GPR52 GPR52 A orphans A Human X-ray 6LI0 6LI0_refined 2.2 A Inactive 32 81 - - - - Flavodoxin - derivative 17 [Nakahata et al., 2018] PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Agonist - - Yes No Lin X, Li M, Wang N, Wu Y, Luo Z, Guo S, Han GW, Li S, Yue Y, Wei X, Xie X, Chen Y, Zhao S, Wu J, Lei M, Xu F 10.1038/S41586-020-2019-0 2020-02-26 Yes
FPR2 FPR2/ALX Formylpeptide A Human cryo-EM 6OMM 6OMM_refined 3.2 R Active 100 85 Gi/o αi1 - 61 - - CHEMBL552527 ChEMBL_compound_ids PubChem
protein Agonist 15-deoxy-LXA4, PrP106-126, LL-37, LXA4, aspirin triggered lipoxin A4, resolvin D1, aspirin-triggered resolvin D1, LTD4, annexin I, serum amyloid A, ATLa2, humanin, LTC4, fMet-Leu-Phe peptide Yes No Zhuang Y, Liu H, Edward Zhou X, Kumar Verma R, de Waal PW, Jang W, Xu TH, Wang L, Meng X, Zhao G, Kang Y, Melcher K, Fan H, Lambert NA, Eric Xu H, Zhang C 10.1038/S41467-020-14728-9 2020-02-26 Yes
PACR PAC1 VIP and PACAP B1 Human cryo-EM 6M1H 6M1H_refined 3.6 A Active 100 73 Gs αs - 54 - Nanobody-35 Maxadilan PubChem
peptide Agonist PACAP-27, PHI, VIP, PHM, PACAP-38, PHV peptide No No Wang J, Song X, Zhang D, Chen X, Li X, Sun Y, Li C, Song Y, Ding Y, Ren R, Harrington EH, Hu LA, Zhong W, Xu C, Huang X, Wang HW, Ma Y 10.1038/S41422-020-0280-2 2020-03-11 Yes
GLR glucagon Glucagon B1 Human cryo-EM 6LMK 6LMK_refined 3.7 R Active 100 83 Gs αs - 59 - Nanobody-35 glucagon PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central Guide To Pharmacology PubChem PubChem PubChem PubChem
peptide Agonist glucagon peptide No No Qiao A, Han S, Li X, Li Z, Zhao P, Dai A, Chang R, Tai L, Tan Q, Chu X, Ma L, Thorsen TS, Reedtz-Runge S, Yang D, Wang MW, Sexton PM, Wootten D, Sun F, Zhao Q, Wu B 10.1126/SCIENCE.AAZ5346 2020-04-01 Yes
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 2Y03 2Y03_refined 2.9 B Inactive 0 62 - - - - - - LEVISOPRENALINE ChEMBL_compound_ids ChEMBL_compound_ids PubChem
small-molecule Agonist - - Yes No Warne T, Moukhametzianov R, Baker JG, Nehme R, Edwards PC, Leslie AG, Schertler GF, Tate CG 10.1038/NATURE09746 2011-01-12 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 3P0G 3P0G_refined 3.5 A Active 100 69 - - - - T4-Lysozyme Nanobody BI-167107 PubChem
small-molecule Agonist (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No Rasmussen SG, Choi HJ, Fung JJ, Pardon E, Casarosa P, Chae PS, Devree BT, Rosenbaum DM, Thian FS, Kobilka TS, Schnapp A, Konetzki I, Sunahara RK, Gellman SH, Pautsch A, Steyaert J, Weis WI, Kobilka BK 10.1038/NATURE09648 2011-01-19 Yes
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 2Y01 - 2.6 A Inactive 0 59 - - - - - - Dobutamine PubChem
small-molecule Agonist (partial) - - Yes No Warne T, Moukhametzianov R, Baker JG, Nehme R, Edwards PC, Leslie AG, Schertler GF, Tate CG 10.1038/NATURE09746 2011-03-30 No
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 2YCZ 2YCZ_refined 3.7 B Inactive 0 60 - - - - - - Iodocyanopindolol PubChem
small-molecule Antagonist - - Yes No Moukhametzianov R, Warne T, Edwards PC, Serrano-Vega MJ, Leslie AG, Tate CG, Schertler GF 10.1073/PNAS.1100185108 2011-06-01 Yes
OPSD Rhodopsin Opsins A Japanese flying squid X-ray 3AYM - 2.8 B Inactive 13 77 - - - - - - Retinal (all-trans) PubChem
small-molecule Agonist - - Yes No Murakami M, Kouyama T 10.1016/J.JMB.2011.08.044 2011-08-17 No
AA2AR A2A Adenosine A Human X-ray 3REY 3REY_refined 3.3 A Inactive 1 71 - - - - - - xanthine amine congener PubChem Guide To Pharmacology ChEMBL_compound_ids Guide To Pharmacology
small-molecule Antagonist adenosine small-molecule Yes No Dore AS, Robertson N, Errey JC, Ng I, Hollenstein K, Tehan B, Hurrell E, Bennett K, Congreve M, Magnani F, Tate CG, Weir M, Marshall FH 10.1016/J.STR.2011.06.014 2011-09-07 Yes
AA2AR A2A Adenosine A Human X-ray 3VG9 3VG9_refined 2.7 A Inactive 1 72 - - - - - Antibody fab fragment light chain
Antibody fab fragment heavy chain		 ZM-241385 PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Antagonist adenosine small-molecule Yes No Hino T, Arakawa T, Iwanari H, Yurugi-Kobayashi T, Ikeda-Suno C, Nakada-Nakura Y, Kusano-Arai O, Weyand S, Shimamura T, Nomura N, Cameron AD, Kobayashi T, Hamakubo T, Iwata S, Murata T 10.1038/NATURE10750 2012-02-01 Yes
ACM3 M3 Acetylcholine (muscarinic) A Rat X-ray 4DAJ - 3.4 A Inactive 3 46 - - - - T4-Lysozyme - tiotropium PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Guide To Pharmacology
small-molecule Antagonist acetylcholine small-molecule Yes No Kruse AC, Hu J, Pan AC, Arlow DH, Rosenbaum DM, Rosemond E, Green HF, Liu T, Chae PS, Dror RO, Shaw DE, Weis WI, Wess J, Kobilka BK 10.1038/NATURE10867 2012-02-22 No
OPRD δ Opioid A Mouse X-ray 4EJ4 4EJ4_refined 3.4 A Inactive 5 76 - - - - T4-Lysozyme - naltrindole PubChem Guide To Pharmacology ChEMBL_compound_ids Guide To Pharmacology
small-molecule Antagonist α-neoendorphin, [Leu]enkephalin, β-endorphin, [Met]enkephalin peptide Yes No Granier S, Manglik A, Kruse AC, Kobilka TS, Thian FS, Weis WI, Kobilka BK 10.1038/NATURE11111 2012-05-16 Yes
NTR1 NTS1 Neurotensin A Rat X-ray 4GRV 4GRV_refined 2.8 A Active 83 69 - - - - T4-Lysozyme - JMV431 Guide To Pharmacology ChEMBL_compound_ids PubChem
peptide Agonist neuromedin N, neurotensin peptide Yes No White JF, Noinaj N, Shibata Y, Love J, Kloss B, Xu F, Gvozdenovic-Jeremic J, Shah P, Shiloach J, Tate CG, Grisshammer R 10.1038/NATURE11558 2012-10-17 Yes
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 4GPO 4GPO_refined 3.5 B Inactive 0 58 - - - - - - Apo (no ligand)
none Apo (no ligand) - - Yes No Huang J, Chen S, Zhang JJ, Huang XY 10.1038/NSMB.2504 2013-02-27 Yes
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 3ZPQ 3ZPQ_refined 2.8 B Inactive 0 62 - - - - - - CHEMBL200234 ChEMBL_compound_ids PubChem
small-molecule Antagonist - - Yes Yes Christopher JA, Brown J, Doré AS, Errey JC, Koglin M, Marshall FH, Myszka DG, Rich RL, Tate CG, Tehan B, Warne T, Congreve M. 10.1021/jm400140q 2013-04-03 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 4BEY 4BEY_refined 2.9 A Active 100 94 Gi/o αt1 Only H5 3 - - Apo (no ligand)
none Apo (no ligand) - - No No Singhal A, Ostermaier MK, Vishnivetskiy SA, Panneels V, Homan KT, Tesmer JJ, Veprintsev D, Deupi X, Gurevich VV, Schertler GF, Standfuss J 10.1038/EMBOR.2013.44 2013-05-08 Yes
CCR5 CCR5 Chemokine A Human X-ray 4MBS 4MBS_refined 2.7 A Inactive 12 83 - - - - Rubredoxin - maraviroc PubChem Guide To Pharmacology DrugBank ChEMBL_compound_ids Guide To Pharmacology
small-molecule Antagonist CCL3, CCL16, CCL4, CCL11, CCL14, CCL13, CCL2, CCL7, CCL5, CCL8 peptide No No Tan Q, Zhu Y, Li J, Chen Z, Han GW, Kufareva I, Li T, Ma L, Fenalti G, Li J, Zhang W, Xie X, Yang H, Jiang H, Cherezov V, Liu H, Stevens RC, Zhao Q, Wu B 10.1126/SCIENCE.1241475 2013-09-11 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 4J4Q 4J4Q_refined 2.7 A Active 100 94 Gi/o αt1 Only H5 3 - - B-Octylglucoside PubChem
small-molecule unknown - - No No Park JH, Morizumi T, Li Y, Hong JE, Pai EF, Hofmann KP, Choe HW, Ernst OP 10.1002/ANIE.201302374 2013-10-30 Yes
OPRD δ Opioid A Human X-ray 4N6H 4N6H_refined 1.8 A Inactive 5 81 - - - - BRIL - naltrindole PubChem Guide To Pharmacology ChEMBL_compound_ids Guide To Pharmacology
small-molecule Antagonist β-endorphin, dynorphin A-(1-13), dynorphin A, endomorphin-1, [Leu]enkephalin, dynorphin A-(1-8), dynorphin B peptide Yes Yes Fenalti G, Giguere PM, Katritch V, Huang XP, Thompson AA, Cherezov V, Roth BL, Stevens RC 10.1038/NATURE12944 2013-12-25 Yes
NTR1 NTS1 Neurotensin A Rat X-ray 4BV0 - 3.1 A Inactive 2 70 - - - - - - neurotensin PubChem Guide To Pharmacology ChEMBL_compound_ids Guide To Pharmacology Guide To Pharmacology
peptide Agonist neuromedin N, neurotensin peptide Yes No Egloff P, Hillenbrand M, Klenk C, Batyuk A, Heine P, Balada S, Schlinkmann KM, Scott DJ, Schutz M, Pluckthun A 10.1073/PNAS.1317903111 2014-01-29 No
P2Y12 P2Y12 P2Y A Human X-ray 4NTJ 4NTJ_refined 2.6 A Intermediate 36 78 - - - - BRIL - AZD1283 PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Antagonist ADP, ATP small-molecule Yes No Zhang K, Zhang J, Gao ZG, Zhang D, Zhu L, Han GW, Moss SM, Paoletta S, Kiselev E, Lu W, Fenalti G, Zhang W, Muller CE, Yang H, Jiang H, Cherezov V, Katritch V, Jacobson KA, Stevens RC, Wu B, Zhao Q 10.1038/NATURE13083 2014-03-26 Yes
GRM5 mGlu5 Metabotropic glutamate C Human X-ray 4OO9 4OO9_refined 2.6 A Inactive 20 20 - - - - T4-Lysozyme - MAVOGLURANT ChEMBL_compound_ids PubChem
small-molecule NAM L-glutamic acid small-molecule No No Dore AS, Okrasa K, Patel JC, Serrano-Vega M, Bennett K, Cooke RM, Errey JC, Jazayeri A, Khan S, Tehan B, Weir M, Wiggin GR, Marshall FH 10.1038/NATURE13396 2014-07-02 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 4QKX 4QKX_refined 3.3 A Active 100 69 - - - - T4-Lysozyme Nanobody Q27453560 PubChem
small-molecule Agonist (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No Weichert D, Kruse AC, Manglik A, Hiller C, Zhang C, Hubner H, Kobilka BK, Gmeiner P 10.1073/PNAS.1410415111 2014-07-23 Yes
ACM3 M3 Acetylcholine (muscarinic) A Rat X-ray 4U16 4U16_refined 3.7 B Inactive 3 47 - - - - T4-Lysozyme - N-methyl scopolamine PubChem Guide To Pharmacology DrugBank Guide To Pharmacology
small-molecule Antagonist acetylcholine small-molecule Yes No Thorsen TS, Matt R, Weis WI, Kobilka BK 10.1016/J.STR.2014.08.022 2014-11-26 Yes
CXCR4 CXCR4 Chemokine A Human X-ray 4RWS 4RWS_refined 3.1 A Inactive 5 78 - - - - T4-Lysozyme - viral macrophage inflammatory protein-II PubChem Guide To Pharmacology
peptide Antagonist CXCL12ε, CXCL12φ, CXCL12β, CXCL12γ, CXCL12, CXCL12δ, CXCL12α peptide Yes No Qin L, Kufareva I, Holden LG, Wang C, Zheng Y, Zhao C, Fenalti G, Wu H, Han GW, Cherezov V, Abagyan R, Stevens RC, Handel TM 10.1126/SCIENCE.1261064 2015-02-11 Yes
AA2AR A2A Adenosine A Human X-ray 4UG2 4UG2_refined 2.6 A Active 73 71 - - - - - - CGS 21680 PubChem Guide To Pharmacology ChEMBL_compound_ids Guide To Pharmacology
small-molecule Agonist adenosine small-molecule Yes No Lebon G, Edwards PC, Leslie AG, Tate CG 10.1124/mol.114.097360 2015-04-08 Yes
OPSD Rhodopsin Opsins A Japanese flying squid X-ray 4WW3 4WW3_refined 2.8 A Inactive 13 78 - - - - - - Retinal (all-trans) PubChem
small-molecule Agonist - - Yes No Murakami M, Kouyama T 10.1371/JOURNAL.PONE.0126970 2015-06-17 Yes
OPRM μ Opioid A Mouse X-ray 5C1M 5C1M_refined 2.1 A Active 100 74 - - - - - Antibody BU72 Guide To Pharmacology PubChem
small-molecule Agonist - - Yes No Huang W, Manglik A, Venkatakrishnan AJ, Laeremans T, Feinberg EN, Sanborn AL, Kato HE, Livingston KE, Thorsen TS, Kling RC, Granier S, Gmeiner P, Husbands SM, Traynor JR, Weis WI, Steyaert J, Dror RO, Kobilka BK 10.1038/NATURE14886 2015-08-05 Yes
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 5A8E 5A8E_refined 2.4 A Inactive 0 59 - - - - - - 7-methylcyanopindolol PubChem
small-molecule Inverse agonist - - Yes Yes Sato T, Baker J, Warne T, Brown GA, Leslie AG, Congreve M, Tate CG 10.1124/MOL.115.101030 2015-09-30 Yes
OPRX NOP Opioid A Human X-ray 5DHH 5DHH_refined 3.0 A Inactive 5 76 - - - - BRIL - SB 612111 PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Antagonist nociceptin/orphanin FQ peptide Yes No Miller RL, Thompson AA, Trapella C, Guerrini R, Malfacini D, Patel N, Han GW, Cherezov V, Calo G, Katritch V, Stevens RC 10.1016/J.STR.2015.07.024 2015-10-21 Yes
OX1R OX1 Orexin A Human X-ray 4ZJ8 4ZJ8_refined 2.8 A Inactive 1 72 - - - - GlgA glycogen synthase - suvorexant PubChem Guide To Pharmacology ChEMBL_compound_ids Drug Central DrugBank
small-molecule Antagonist orexin-A, orexin-B peptide No No Yin J, Babaoglu K, Brautigam CA, Clark L, Shao Z, Scheuermann TH, Harrell CM, Gotter AL, Roecker AJ, Winrow CJ, Renger JJ, Coleman PJ, Rosenbaum DM 10.1038/NSMB.3183 2016-03-09 Yes
ACM4 M4 Acetylcholine (muscarinic) A Human X-ray 5DSG 5DSG_refined 2.6 B Inactive 3 60 - - - - T4-Lysozyme - tiotropium PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Guide To Pharmacology
small-molecule Antagonist acetylcholine small-molecule Yes No Thal DM, Sun B, Feng D, Nawaratne V, Leach K, Felder CC, Bures MG, Evans DA, Weis WI, Bachhawat P, Kobilka TS, Sexton PM, Kobilka BK, Christopoulos A 10.1038/NATURE17188 2016-03-16 Yes
AA2AR A2A Adenosine A Human X-ray 5IU7 5IU7_refined 1.9 A Inactive 1 72 - - - - BRIL - 2-(Furan-2-yl)-5-N-[2-(4-phenylpiperidin-1-yl)ethyl]-1H-[1,2,4]triazolo[1,5-a][1,3,5]triazin-8-ium-5,7-diamine PubChem
small-molecule Antagonist adenosine small-molecule Yes Yes Segala E, Guo D, Cheng RK, Bortolato A, Deflorian F, Doré AS, Errey JC, Heitman LH, IJzerman AP, Marshall FH, Cooke RM. 10.1021/acs.jmedchem.6b00653 2016-06-29 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 5JQH 5JQH_refined 3.2 A Inactive 0 70 - - - - T4-Lysozyme Nanobody Carazolol PubChem
small-molecule Inverse agonist (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No Staus DP, Strachan RT, Manglik A, Pani B, Kahsai AW, Kim TH, Wingler LM, Ahn S, Chatterjee A, Masoudi A, Kruse AC, Pardon E, Steyaert J, Weis WI, Prosser RS, Kobilka BK, Costa T, Lefkowitz RJ 10.1038/NATURE18636 2016-07-13 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 5DYS 5DYS_refined 2.3 A Active 99 94 - - - - - - Retinal (all-trans) PubChem
small-molecule Agonist - - No No Singhal A, Guo Y, Matkovic M, Schertler G, Deupi X, Yan EC, Standfuss J 10.15252/EMBR.201642671 2016-08-10 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 5EN0 5EN0_refined 2.8 A Active 100 94 Gi/o αt3 Only H5 3 - - Retinal (all-trans) PubChem
small-molecule Agonist - - No No Singhal A, Guo Y, Matkovic M, Schertler G, Deupi X, Yan EC, Standfuss J 10.15252/EMBR.201642671 2016-08-10 Yes
AA2AR A2A Adenosine A Human X-ray 5K2A 5K2A_refined 2.5 A Inactive 1 72 - - - - BRIL - ZM-241385 PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Antagonist adenosine small-molecule Yes Yes Batyuk A, Galli L, Ishchenko A, Han GW, Gati C, Popov PA, Lee MY, Stauch B, White TA, Barty A, Aquila A, Hunter MS, Liang M, Boutet S, Pu M, Liu ZJ, Nelson G, James D, Li C, Zhao Y, Spence JC, Liu W, Fromme P, Katritch V, Weierstall U, Stevens RC, Cherezov V 10.1126/SCIADV.1600292 2016-09-21 Yes
CNR1 CB1 Cannabinoid A Human X-ray 5TGZ 5TGZ_refined 2.8 A Inactive 8 61 - - - - Flavodoxin - AM6538 PubChem Guide To Pharmacology
small-molecule Antagonist 2-arachidonoylglycerol, anandamide small-molecule Yes No Hua T, Vemuri K, Pu M, Qu L, Han GW, Wu Y, Zhao S, Shui W, Li S, Korde A, Laprairie RB, Stahl EL, Ho JH, Zvonok N, Zhou H, Kufareva I, Wu B, Zhao Q, Hanson MA, Bohn LM, Makriyannis A, Stevens RC, Liu ZJ 10.1016/J.CELL.2016.10.004 2016-11-02 Yes
NTR1 NTS1 Neurotensin A Rat X-ray 5T04 5T04_refined 3.3 A Active 83 69 - - - - T4-Lysozyme - neurotensin PubChem Guide To Pharmacology ChEMBL_compound_ids Guide To Pharmacology Guide To Pharmacology
peptide Agonist neuromedin N, neurotensin peptide Yes No Krumm BE, Lee S, Bhattacharya S, Botos I, White CF, Du H, Vaidehi N, Grisshammer R 10.1038/SREP38564 2016-12-21 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 5TE3 5TE3_refined 2.7 A Active 99 94 - - - - - - B-Octylglucoside PubChem
small-molecule unknown - - No No Gulati S, Jastrzebska B, Banerjee S, Placeres AL, Miszta P, Gao S, Gunderson K, Tochtrop GP, Filipek S, Katayama K, Kiser PD, Mogi M, Stewart PL, Palczewski K 10.1073/PNAS.1617446114 2017-03-15 Yes
AGTR2 AT2 Angiotensin A Human X-ray 5UNG 5UNG_refined 2.8 B Active 99 83 - - - - BRIL - compound 1 [PMID: 28379944] PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Antagonist angiotensin-(1-7), angiotensin II, angiotensin III peptide Yes No Zhang H, Han GW, Batyuk A, Ishchenko A, White KL, Patel N, Sadybekov A, Zamlynny B, Rudd MT, Hollenstein K, Tolstikova A, White TA, Hunter MS, Weierstall U, Liu W, Babaoglu K, Moore EL, Katz RD, Shipman JM, Garcia-Calvo M, Sharma S, Sheth P, Soisson SM, Stevens RC, Katritch V, Cherezov V 10.1038/NATURE22035 2017-04-05 Yes
PAR2 PAR2 Proteinase-activated A Human X-ray 5NJ6 5NJ6_refined 4.0 A Intermediate 36 74 - - - - BRIL Fab3949 - - - - - Yes No Cheng RKY, Fiez-Vandal C, Schlenker O, Edman K, Aggeler B, Brown DG, Brown GA, Cooke RM, Dumelin CE, Dore AS, Geschwindner S, Grebner C, Hermansson NO, Jazayeri A, Johansson P, Leong L, Prihandoko R, Rappas M, Soutter H, Snijder A, Sundstrom L, Tehan B, Thornton P, Troast D, Wiggin G, Zhukov A, Marshall FH, Dekker N 10.1038/NATURE22309 2017-05-03 Yes
SMO SMO Frizzled F Human X-ray 5V56 5V56_refined 2.9 B Inactive 1 61 - - - - Flavodoxin - N-methyl-N-[1-[4-(2-methylpyrazol-3-yl)phthalazin-1-yl]piperidin-4-yl]-4-nitro-2-(trifluoromethyl)benzamide PubChem
small-molecule Antagonist - - No No Zhang X, Zhao F, Wu Y, Yang J, Han GW, Zhao S, Ishchenko A, Ye L, Lin X, Ding K, Dharmarajan V, Griffin PR, Gati C, Nelson G, Hunter MS, Hanson MA, Cherezov V, Stevens RC, Tan W, Tao H, Xu F 10.1038/NCOMMS15383 2017-05-24 Yes
GLR glucagon Glucagon B1 Human X-ray 5XEZ 5XEZ_refined 3.0 B Inactive 0 82 - - - - T4-Lysozyme Antibody NNC0640 PubChem Guide To Pharmacology
small-molecule NAM glucagon peptide No No Zhang H, Qiao A, Yang D, Yang L, Dai A, de Graaf C, Reedtz-Runge S, Dharmarajan V, Zhang H, Han GW, Grant TD, Sierra RG, Weierstall U, Nelson G, Liu W, Wu Y, Ma L, Cai X, Lin G, Wu X, Geng Z, Dong Y, Song G, Griffin PR, Lau J, Cherezov V, Yang H, Hanson MA, Stevens RC, Zhao Q, Jiang H, Wang MW, Wu B 10.1038/NATURE22363 2017-05-24 Yes
FFAR1 FFA1 Free fatty acid A Human X-ray 5TZR 5TZR_refined 2.2 A Intermediate 46 91 - - - - T4-Lysozyme - MK-8666 PubChem
small-molecule Agonist oleic acid, myristic acid, docosahexaenoic acid, α-linolenic acid small-molecule No No Lu J, Byrne N, Wang J, Bricogne G, Brown FK, Chobanian HR, Colletti SL, Di Salvo J, Thomas-Fowlkes B, Guo Y, Hall DL, Hadix J, Hastings NB, Hermes JD, Ho T, Howard AD, Josien H, Kornienko M, Lumb KJ, Miller MW, Patel SB, Pio B, Plummer CW, Sherborne BS, Sheth P, Souza S, Tummala S, Vonrhein C, Webb M, Allen SJ, Johnston JM, Weinglass AB, Sharma S, Soisson SM 10.1038/NSMB.3417 2017-06-07 Yes
CNR1 CB1 Cannabinoid A Human X-ray 5XR8 5XR8_refined 3.0 A Active 97 60 - - - - Flavodoxin - AM841 PubChem Guide To Pharmacology
small-molecule Agonist 2-arachidonoylglycerol, anandamide small-molecule Yes No Hua T, Vemuri K, Nikas SP, Laprairie RB, Wu Y, Qu L, Pu M, Korde A, Jiang S, Ho JH, Han GW, Ding K, Li X, Liu H, Hanson MA, Zhao S, Bohn LM, Makriyannis A, Stevens RC, Liu ZJ 10.1038/NATURE23272 2017-07-12 Yes
AA2AR A2A Adenosine A Human X-ray 5MZP 5MZP_refined 2.1 A Inactive 1 71 - - - - BRIL - caffeine PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central
small-molecule Antagonist adenosine small-molecule Yes Yes Cheng RKY, Segala E, Robertson N, Deflorian F, Dore AS, Errey JC, Fiez-Vandal C, Marshall FH, Cooke RM 10.1016/j.str.2017.06.012 2017-07-26 Yes
OPSD Rhodopsin Opsins A Human X-ray 5W0P 5W0P_refined 3.0 D Active 100 93 Visual S-arrestin - 90 T4-Lysozyme - Apo (no ligand)
none Apo (no ligand) - - No No Zhou XE, He Y, de Waal PW, Gao X, Kang Y, Van Eps N, Yin Y, Pal K, Goswami D, White TA, Barty A, Latorraca NR, Chapman HN, Hubbell WL, Dror RO, Stevens RC, Cherezov V, Gurevich VV, Griffin PR, Ernst OP, Melcher K, Xu HE 10.1016/J.CELL.2017.07.002 2017-08-09 Yes
AA2AR A2A Adenosine A Human X-ray 5NM4 5NM4_refined 1.7 A Inactive 1 73 - - - - BRIL - ZM-241385 PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Antagonist adenosine small-molecule Yes No Weinert T, Olieric N, Cheng R, Brunle S, James D, Ozerov D, Gashi D, Vera L, Marsh M, Jaeger K, Dworkowski F, Panepucci E, Basu S, Skopintsev P, Dore AS, Geng T, Cooke RM, Liang M, Prota AE, Panneels V, Nogly P, Ermler U, Schertler G, Hennig M, Steinmetz MO, Wang M, Standfuss J 10.1038/S41467-017-00630-4 2017-09-27 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 5WKT 5WKT_refined 3.2 A Active 100 94 Gi/o αt1 Only H5 3 - - B-Octylglucoside PubChem
small-molecule unknown - - No No Broecker J, Morizumi T, Ou WL, Klingel V, Kuo A, Kissick DJ, Ishchenko A, Lee MY, Xu S, Makarov O, Cherezov V, Ogata CM, Ernst OP 10.1038/NPROT.2017.135 2017-12-13 Yes
C5AR1 C5a1 Complement peptide A Human X-ray 5O9H 5O9H_refined 2.7 A Inactive 6 84 - - - - - - NDT9513727 PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Antagonist ribosomal protein S19, C5a, C5a des-Arg, C3a peptide Yes No Robertson N, Rappas M, Dore AS, Brown J, Bottegoni G, Koglin M, Cansfield J, Jazayeri A, Cooke RM, Marshall FH 10.1038/NATURE25025 2018-01-10 Yes
AA2AR A2A Adenosine A Human X-ray 5OLO 5OLO_refined 3.1 A Inactive 1 72 - - - - BRIL - tozadenant PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Antagonist adenosine small-molecule Yes No Rucktooa P, Cheng RKY, Segala E, Geng T, Errey JC, Brown GA, Cooke RM, Marshall FH, Dore AS 10.1038/S41598-017-18570-W 2018-01-17 Yes
AA2AR A2A Adenosine A Human X-ray 5OM4 5OM4_refined 2.0 A Inactive 1 72 - - - - BRIL - CHEMBL2024114 ChEMBL_compound_ids PubChem
small-molecule Antagonist adenosine small-molecule Yes Yes Rucktooa P, Cheng RKY, Segala E, Geng T, Errey JC, Brown GA, Cooke RM, Marshall FH, Dore AS 10.1038/S41598-017-18570-W 2018-01-17 Yes
5HT2C 5-HT2C 5-Hydroxytryptamine A Human X-ray 6BQG 6BQG_refined 3.0 A Active 92 62 - - - - BRIL - ergotamine PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central
small-molecule Agonist 5-hydroxytryptamine small-molecule Yes No Peng Y, McCorvy JD, Harpsoe K, Lansu K, Yuan S, Popov P, Qu L, Pu M, Che T, Nikolajsen LF, Huang XP, Wu Y, Shen L, Bjorn-Yoshimoto WE, Ding K, Wacker D, Han GW, Cheng J, Katritch V, Jensen AA, Hanson MA, Zhao S, Gloriam DE, Roth BL, Stevens RC, Liu ZJ 10.1016/j.cell.2018.01.001 2018-02-14 Yes
GLP1R GLP-1 Glucagon B1 Human cryo-EM 6B3J 6B3J_refined 3.3 R Active 100 82 Gs αs - 49 - - Exendin-P5
peptide Agonist glucagon-like peptide 1-(7-36) amide, glucagon, glucagon-like peptide 1-(7-37) peptide No No Liang YL, Khoshouei M, Glukhova A, Furness SGB, Zhao P, Clydesdale L, Koole C, Truong TT, Thal DM, Lei S, Radjainia M, Danev R, Baumeister W, Wang MW, Miller LJ, Christopoulos A, Sexton PM, Wootten D 10.1038/NATURE25773 2018-02-21 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 6FK9 6FK9_refined 2.6 A Active 99 94 - - - - - - (2~{S})-3-methyl-2-phenyl-1-spiro[1,3-benzodioxole-2,4'-piperidine]-1'-yl-butan-1-one PubChem
small-molecule Agonist - - No No Mattle D, Kuhn B, Aebi J, Bedoucha M, Kekilli D, Grozinger N, Alker A, Rudolph MG, Schmid G, Schertler GFX, Hennig M, Standfuss J, Dawson RJP 10.1073/PNAS.1718084115 2018-04-04 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 6FKD 6FKD_refined 2.5 A Active 99 94 - - - - - - 5-chloro-2-(2-oxo-2-spiro[1,3-benzodioxole-2,4'-piperidine]-1'-ylethyl)-3H-pyridin-6-one PubChem
small-molecule Agonist - - No No Mattle D, Kuhn B, Aebi J, Bedoucha M, Kekilli D, Grozinger N, Alker A, Rudolph MG, Schmid G, Schertler GFX, Hennig M, Standfuss J, Dawson RJP 10.1073/PNAS.1718084115 2018-04-04 Yes
AA2AR A2A Adenosine A Human cryo-EM 6GDG 6GDG_refined 4.1 A Active 100 64 Gs αs - 57 TrxA Nanobody-35 NECA PubChem Guide To Pharmacology ChEMBL_compound_ids Guide To Pharmacology
small-molecule Agonist adenosine small-molecule Yes No Garcia-Nafria J, Lee Y, Bai X, Carpenter B, Tate CG 10.7554/ELIFE.35946 2018-05-16 Yes
Q80KM9 US28 Unclassified A strain AD169 X-ray 5WB1 5WB1_refined 3.5 A Active 100 82 - - - - - Nanobody - - - - - Yes No Miles TF, Spiess K, Jude KM, Tsutsumi N, Burg JS, Ingram JR, Waghray D, Hjorto GM, Larsen O, Ploegh HL, Rosenkilde MM, Garcia KC 10.7554/ELIFE.35850 2018-06-13 Yes
OPRM μ Opioid A Mouse cryo-EM 6DDF 6DDF_refined 3.5 R Active 100 71 Gi/o αi1 - 61 - - DAMGO PubChem Guide To Pharmacology ChEMBL_compound_ids ChEMBL_compound_ids
peptide Agonist - - Yes No Koehl A, Hu H, Maeda S, Zhang Y, Qu Q, Paggi JM, Latorraca NR, Hilger D, Dawson R, Matile H, Schertler GFX, Granier S, Weis WI, Dror RO, Manglik A, Skiniotis G, Kobilka BK 10.1038/S41586-018-0219-7 2018-06-13 Yes
5HT1B 5-HT1B 5-Hydroxytryptamine A Human cryo-EM 6G79 6G79_refined 3.8 S Active 100 67 Gi/o αo - 59 - - donitriptan PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Agonist tryptamine, 5-hydroxytryptamine, 5-HT-moduline small-molecule Yes No Garcia-Nafria J, Nehme R, Edwards PC, Tate CG 10.1038/S41586-018-0241-9 2018-06-20 Yes
5HT2B 5-HT2B 5-Hydroxytryptamine A Human X-ray 6DRY 6DRY_refined 2.9 A Intermediate 36 60 - - - - BRIL - methylergonovine PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central
small-molecule Agonist 5-hydroxytryptamine small-molecule Yes No McCorvy JD, Wacker D, Wang S, Agegnehu B, Liu J, Lansu K, Tribo AR, Olsen RHJ, Che T, Jin J, Roth BL 10.1038/s41594-018-0116-7 2018-08-29 Yes
PD2R2 DP2 Prostanoid A Human X-ray 6D26 6D26_refined 2.8 A Inactive 19 82 - - - - T4-Lysozyme - fevipiprant PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Antagonist PGF2α, PGE2, PGJ2, thromboxane A2, PGD3, PGD2, PGI2 small-molecule Yes No Wang L, Yao D, Deepak RNVK, Liu H, Xiao Q, Fan H, Gong W, Wei Z, Zhang C 10.1016/J.MOLCEL.2018.08.009 2018-10-03 Yes
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 6H7J 6H7J_refined 2.8 A Active 100 60 - - - - Thioredoxin 1 Camelid antibody fragment Nb80 LEVISOPRENALINE ChEMBL_compound_ids ChEMBL_compound_ids PubChem
small-molecule Agonist - - Yes No Warne T, Edwards PC, Dore AS, Leslie AGW, Tate CG 10.1126/SCIENCE.AAU5595 2018-10-17 Yes
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 6H7O 6H7O_refined 2.8 A Active 100 60 - - - - Thioredoxin 1 Camelid antibody fragment Nb6B9 (S)-Cyanopindolol PubChem
small-molecule Agonist - - Yes No Warne T, Edwards PC, Dore AS, Leslie AGW, Tate CG 10.1126/SCIENCE.AAU5595 2018-10-17 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 6MXT 6MXT_refined 3.0 A Active 100 69 - - - - T4-Lysozyme Nanobody-71 salmeterol PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central
small-molecule Agonist (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No Masureel M, Zou Y, Picard LP, van der Westhuizen E, Mahoney JP, Rodrigues JPGLM, Mildorf TJ, Dror RO, Shaw DE, Bouvier M, Pardon E, Steyaert J, Sunahara RK, Weis WI, Zhang C, Kobilka BK 10.1038/s41589-018-0145-x 2018-11-14 Yes
EDNRB ETB Endothelin A Human X-ray 6IGK 6IGK_refined 2.0 A Inactive 4 70 - - - - T4-Lysozyme - endothelin-3 PubChem Guide To Pharmacology
peptide Agonist endothelin-2, endothelin-1, endothelin-3 peptide Yes No Shihoya W, Izume T, Inoue A, Yamashita K, Kadji FMN, Hirata K, Aoki J, Nishizawa T, Nureki O 10.1038/S41467-018-07094-0 2018-11-21 Yes
PE2R4 EP4 Prostanoid A Human X-ray 5YHL 5YHL_refined 4.2 A Inactive 10 57 - - - - - Fab ONO-AE3-208-Br PubChem
small-molecule Antagonist PGE1, PGF2α, PGE2, thromboxane A2, PGD2, PGI2 small-molecule No No Toyoda Y, Morimoto K, Suno R, Horita S, Yamashita K, Hirata K, Sekiguchi Y, Yasuda S, Shiroishi M, Shimizu T, Urushibata Y, Kajiwara Y, Inazumi T, Hotta Y, Asada H, Nakane T, Shiimura Y, Nakagita T, Tsuge K, Yoshida S, Kuribara T, Hosoya T, Sugimoto Y, Nomura N, Sato M, Hirokawa T, Kinoshita M, Murata T, Takayama K, Yamamoto M, Narumiya S, Iwata S, Kobayashi T 10.1038/S41589-018-0131-3 2018-12-05 Yes
NK1R NK1 Tachykinin A Human X-ray 6E59 6E59_refined 3.4 A Inactive 1 70 - - - - GlgA glycogen synthase - L760735 PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Antagonist neurokinin B, neuropeptide K, substance P, hemokinin 1, neuropeptide-γ, neurokinin A peptide Yes No Yin J, Chapman K, Clark LD, Shao Z, Borek D, Xu Q, Wang J, Rosenbaum DM 10.1073/PNAS.1812717115 2018-12-12 Yes
TA2R TP Prostanoid A Human X-ray 6IIV 6IIV_refined 3.0 A Intermediate 46 87 - - - - Rubredoxin - daltroban PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Antagonist PGF2α, PGE2, PGI2, PGH2, PGD2, thromboxane A2 small-molecule No No Fan H, Chen S, Yuan X, Han S, Zhang H, Xia W, Xu Y, Zhao Q, Wu B 10.1038/S41589-018-0170-9 2018-12-19 Yes
CCR2 CCR2 Chemokine A Human X-ray 6GPX 6GPX_refined 2.7 B Inactive 12 70 - - - - Rubredoxin - MK-0812 PubChem
small-molecule Antagonist CCL16, CCL11, CCL26, CCL13, CCL24, CCL2, CCL7, CCL8 peptide No No Apel AK, Cheng RKY, Tautermann CS, Brauchle M, Huang CY, Pautsch A, Hennig M, Nar H, Schnapp G 10.1016/J.STR.2018.10.027 2019-01-02 Yes
NK1R NK1 Tachykinin A Human X-ray 6HLL 6HLL_refined 3.3 A Inactive 1 67 - - - - GlgA glycogen synthase - CP 99994 PubChem Guide To Pharmacology ChEMBL_compound_ids
small-molecule Antagonist neurokinin B, neuropeptide K, substance P, hemokinin 1, neuropeptide-γ, neurokinin A peptide Yes No Schoppe J, Ehrenmann J, Klenk C, Rucktooa P, Schutz M, Dore AS, Pluckthun A 10.1038/S41467-018-07939-8 2019-01-16 Yes
NK1R NK1 Tachykinin A Human X-ray 6HLP 6HLP_refined 2.2 A Inactive 1 71 - - - - GlgA glycogen synthase - netupitant PubChem Guide To Pharmacology ChEMBL_compound_ids Drug Central DrugBank
small-molecule Antagonist neurokinin B, neuropeptide K, substance P, hemokinin 1, neuropeptide-γ, neurokinin A peptide Yes No Schoppe J, Ehrenmann J, Klenk C, Rucktooa P, Schutz M, Dore AS, Pluckthun A 10.1038/S41467-018-07939-8 2019-01-16 Yes
GRM5 mGlu5 Metabotropic glutamate C Human cryo-EM 6N52 6N52_refined 4.0 A Inactive 29 64 - - - - - Nanobody-43 - - - L-glutamic acid small-molecule No No Koehl A, Hu H, Feng D, Sun B, Zhang Y, Robertson MJ, Chu M, Kobilka TS, Laeremans T, Steyaert J, Tarrasch J, Dutta S, Fonseca R, Weis WI, Mathiesen JM, Skiniotis G, Kobilka BK 10.1038/S41586-019-0881-4 2019-01-23 Yes
CNR2 CB2 Cannabinoid A Human X-ray 5ZTY 5ZTY_refined 2.8 A Inactive 8 80 - - - - T4-Lysozyme - AM10257 Guide To Pharmacology PubChem
small-molecule Antagonist 2-arachidonoylglycerol, anandamide small-molecule Yes No Li X, Hua T, Vemuri K, Ho JH, Wu Y, Wu L, Popov P, Benchama O, Zvonok N, Locke K, Qu L, Han GW, Iyer MR, Cinar R, Coffey NJ, Wang J, Wu M, Katritch V, Zhao S, Kunos G, Bohn LM, Makriyannis A, Stevens RC, Liu ZJ 10.1016/J.CELL.2018.12.011 2019-01-30 Yes
AGTR1 AT1 Angiotensin A Human X-ray 6DO1 6DO1_refined 2.9 A Active 91 85 - - - - BRIL Nanobody-Nb.AT110i1 CHEMBL404594 ChEMBL_compound_ids PubChem
protein Agonist angiotensin IV, angiotensin A, angiotensin II, angiotensin III peptide Yes No Wingler LM, McMahon C, Staus DP, Lefkowitz RJ, Kruse AC 10.1016/J.CELL.2018.12.006 2019-01-30 Yes
5HT2A 5-HT2A 5-Hydroxytryptamine A Human X-ray 6A93 6A93_refined 3.0 A Inactive 1 60 - - - - BRIL - risperidone PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central
small-molecule Antagonist tryptamine, 5-hydroxytryptamine small-molecule No No Kimura KT, Asada H, Inoue A, Kadji FMN, Im D, Mori C, Arakawa T, Hirata K, Nomura Y, Nomura N, Aoki J, Iwata S, Shimamura T 10.1038/S41594-018-0180-Z 2019-02-13 Yes
NK1R NK1 Tachykinin A Human X-ray 6J20 6J20_refined 2.7 A Inactive 1 71 - - - - T4-Lysozyme - aprepitant PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank Drug Central PubChem
small-molecule Antagonist neurokinin B, neuropeptide K, substance P, hemokinin 1, neuropeptide-γ, neurokinin A peptide No No Chen S, Lu M, Liu D, Yang L, Yi C, Ma L, Zhang H, Liu Q, Frimurer TM, Wang MW, Schwartz TW, Stevens RC, Wu B, Wuthrich K, Zhao Q 10.1038/S41467-019-08568-5 2019-03-06 Yes
PTH1R PTH1 Parathyroid hormone B1 Human cryo-EM 6NBF 6NBF_refined 3.0 R Active 100 62 Gs αs - 58 - Nanobody-35 Long-acting parathyroid hormone analog
peptide Agonist PTH, PTHrP-(1-36), TIP39, PTHrP peptide No No Zhao LH, Ma S, Sutkeviciute I, Shen DD, Zhou XE, de Waal PW, Li CY, Kang Y, Clark LJ, Jean-Alphonse FG, White AD, Yang D, Dai A, Cai X, Chen J, Li C, Jiang Y, Watanabe T, Gardella TJ, Melcher K, Wang MW, Vilardaga JP, Xu HE, Zhang Y 10.1126/SCIENCE.AAV7942 2019-04-17 Yes
PTH1R PTH1 Parathyroid hormone B1 Human cryo-EM 6NBI 6NBI_refined 4.0 R Active 100 62 Gs αs - 56 - Nanobody-35 Long-acting parathyroid hormone analog
peptide Agonist PTH, PTHrP-(1-36), TIP39, PTHrP peptide No No Zhao LH, Ma S, Sutkeviciute I, Shen DD, Zhou XE, de Waal PW, Li CY, Kang Y, Clark LJ, Jean-Alphonse FG, White AD, Yang D, Dai A, Cai X, Chen J, Li C, Jiang Y, Watanabe T, Gardella TJ, Melcher K, Wang MW, Vilardaga JP, Xu HE, Zhang Y 10.1126/SCIENCE.AAV7942 2019-04-17 Yes
MTR1A MT1 Melatonin A Human X-ray 6ME4 6ME4_refined 3.2 A Inactive 1 83 - - - - GlgA glycogen synthase - 2-iodo-melatonin PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Agonist melatonin small-molecule No No Stauch B, Johansson LC, McCorvy JD, Patel N, Han GW, Huang XP, Gati C, Batyuk A, Slocum ST, Ishchenko A, Brehm W, White TA, Michaelian N, Madsen C, Zhu L, Grant TD, Grandner JM, Shiriaeva A, Olsen RHJ, Tribo AR, Yous S, Stevens RC, Weierstall U, Katritch V, Roth BL, Liu W, Cherezov V 10.1038/S41586-019-1141-3 2019-04-24 Yes
MTR1B MT2 Melatonin A Human X-ray 6ME6 6ME6_refined 2.8 B Inactive 1 78 - - - - Rubredoxin - 2-phenylmelatonin PubChem
small-molecule Agonist melatonin small-molecule No No Johansson LC, Stauch B, McCorvy JD, Han GW, Patel N, Huang XP, Batyuk A, Gati C, Slocum ST, Li C, Grandner JM, Hao S, Olsen RHJ, Tribo AR, Zaare S, Zhu L, Zatsepin NA, Weierstall U, Yous S, Stevens RC, Liu W, Roth BL, Katritch V, Cherezov V 10.1038/S41586-019-1144-0 2019-04-24 Yes
MTR1B MT2 Melatonin A Human X-ray 6ME8 6ME8_refined 3.1 B Inactive 1 78 - - - - Rubredoxin - 2-phenylmelatonin PubChem
small-molecule Agonist melatonin small-molecule Yes No Johansson LC, Stauch B, McCorvy JD, Han GW, Patel N, Huang XP, Batyuk A, Gati C, Slocum ST, Li C, Grandner JM, Hao S, Olsen RHJ, Tribo AR, Zaare S, Zhu L, Zatsepin NA, Weierstall U, Yous S, Stevens RC, Liu W, Roth BL, Katritch V, Cherezov V 10.1038/S41586-019-1144-0 2019-04-24 Yes
AA2AR A2A Adenosine A Human X-ray 6MH8 6MH8_refined 4.2 A Inactive 1 72 - - - - BRIL - ZM-241385 PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Antagonist adenosine small-molecule Yes No Martin-Garcia JM, Zhu L, Mendez D, Lee MY, Chun E, Li C, Hu H, Subramanian G, Kissick D, Ogata C, Henning R, Ishchenko A, Dobson Z, Zhang S, Weierstall U, Spence JCH, Fromme P, Zatsepin NA, Fischetti RF, Cherezov V, Liu W 10.1107/S205225251900263X 2019-04-24 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 6E67 6E67_refined 3.7 B Active 100 72 Gs αs Fused partial Gs 44 T4-Lysozyme - BI-167107 PubChem
small-molecule Agonist (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No Liu X, Xu X, Hilger D, Aschauer P, Tiemann JKS, Du Y, Liu H, Hirata K, Sun X, Guixa-Gonzalez R, Mathiesen JM, Hildebrand PW, Kobilka BK 10.1016/J.CELL.2019.04.021 2019-06-05 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 6N48 6N48_refined 3.2 A Active 100 70 - - - - T4-Lysozyme Camelid Antibody Fragment BI-167107 PubChem
2-[[(3R)-4-(4-Tert-butylphenyl)-3-[[2-(4-methoxyphenyl)sulfanyl-5-[methyl(propan-2-yl)sulfamoyl]benzoyl]amino]butanoyl]amino]acetic acid PubChem
small-molecule
small-molecule		 Agonist
PAM		 (-)-adrenaline, L-NOREPINEPHRINE, noradrenaline, (-)-noradrenaline, Zn2+ small-molecule Yes No Liu X, Masoudi A, Kahsai AW, Huang LY, Pani B, Staus DP, Shim PJ, Hirata K, Simhal RK, Schwalb AM, Rambarat PK, Ahn S, Lefkowitz RJ, Kobilka B 10.1126/SCIENCE.AAW8981 2019-06-26 Yes
NTR1 NTS1 Neurotensin A Human cryo-EM 6OSA 6OSA_refined 3.0 R Active 100 77 Gi/o αi1 Non-canonical conformation 62 - - JMV449 PubChem Guide To Pharmacology ChEMBL_compound_ids
peptide Agonist neurotensin, large neurotensin, neuromedin N, large neuromedin N peptide Yes No Kato HE, Zhang Y, Hu H, Suomivuori CM, Kadji FMN, Aoki J, Krishna Kumar K, Fonseca R, Hilger D, Huang W, Latorraca NR, Inoue A, Dror RO, Kobilka BK, Skiniotis G 10.1038/S41586-019-1337-6 2019-07-10 Yes
OPSD Rhodopsin Opsins A Bovine cryo-EM 6OYA 6OYA_refined 3.3 R Active 100 94 Gi/o αt1 - 59 - Camelid antibody VHH fragment Retinal (all-trans) PubChem
small-molecule Agonist - - No No Gao Y, Hu H, Ramachandran S, Erickson JW, Cerione RA, Skiniotis G 10.1016/J.MOLCEL.2019.06.007 2019-07-24 Yes
AA2AR A2A Adenosine A Human X-ray 6JZH 6JZH_refined 2.3 A Inactive 1 72 - - - - BRIL - ZM-241385 PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank
small-molecule Antagonist adenosine small-molecule Yes Yes Shimazu Y, Tono K, Tanaka T, Yamanaka Y, Nakane T, Mori C, Terakado Kimura K, Fujiwara T, Sugahara M, Tanaka R, Doak RB, Shimamura T, Iwata S, Nango E, Yabashi M 10.1107/S1600576719012846 2019-10-30 Yes
GLP1R GLP-1 Glucagon B1 Human X-ray 6KK1 6KK1_refined 2.8 B Inactive 0 57 - - - - T4-Lysozyme - PF-06372222 PubChem
small-molecule NAM glucagon-like peptide 1-(7-36) amide, glucagon, glucagon-like peptide 1-(7-37) peptide No No Xu Y, Wang Y, Wang Y, Liu K, Peng Y, Yao D, Tao H, Liu H, Song G 10.1107/S2052252519013496 2019-11-13 Yes
ADRB2 β2 Adr