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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)
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)
small-molecule Inverse agonist - - No No Teller DC, Okada T, Behnke CA, Palczewski K, Stenkamp RE 10.1021/BI0155091 2001-07-04 No
OPSD Rhodopsin Opsins A Bovine X-ray 1L9H - 2.6 A Inactive 22 98 - - - - - - Retinal (11-cis)
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)
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)
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)
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)
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)
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)
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)
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 - 2.4 A Inactive 0 68 - - - - T4-Lysozyme - Carazolol
small-molecule Inverse agonist (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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 - - - (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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 - - - (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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
OPSD Rhodopsin Opsins A Japanese flying squid X-ray 2ZIY - 3.7 A Inactive 13 83 - - - - - - Retinal (11-cis)
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)
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
small-molecule Inverse agonist (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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
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
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 2VT4 - 2.7 B Inactive 0 57 - - - - - - (S)-Cyanopindolol
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 3C9L 3C9L_refined 2.7 A Inactive 22 94 - - - - - - Retinal (11-cis)
small-molecule Inverse agonist - - No No Stenkamp RE 10.1107/S0907444908017162 2008-08-05 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 3C9M - 3.4 A Inactive 22 94 - - - - - - Retinal (11-cis)
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
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 - - - (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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
small-molecule Inverse agonist (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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
small-molecule Inverse agonist (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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
small-molecule Antagonist (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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
small-molecule Antagonist CXCL12δ, CXCL12φ, CXCL12ε, CXCL12β, CXCL12γ, CXCL12, 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 - 2.9 A Inactive 5 78 - - - - T4-Lysozyme - CVX15
peptide Antagonist CXCL12δ, CXCL12φ, CXCL12ε, CXCL12β, CXCL12γ, CXCL12, 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
small-molecule Antagonist CXCL12δ, CXCL12φ, CXCL12ε, CXCL12β, CXCL12γ, CXCL12, 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
small-molecule Antagonist CXCL12δ, CXCL12φ, CXCL12ε, CXCL12β, CXCL12γ, CXCL12, 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
small-molecule Antagonist CXCL12δ, CXCL12φ, CXCL12ε, CXCL12β, CXCL12γ, CXCL12, 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
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
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 2Y03 2Y03_refined 2.9 B Inactive 0 62 - - - - - - LEVISOPRENALINE
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
OPSD Rhodopsin Opsins A Bovine X-ray 3PQR - 2.9 A Active 100 94 Gi/o αt1 Only H5 3 - - Retinal (all-trans)
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 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 2X72 2X72_refined 3.0 A Active 100 94 Gi/o αt1 Only H5 3 - - Retinal (all-trans)
small-molecule Agonist - - No No Standfuss J, Edwards PC, D'Antona A, Fransen M, Xie G, Oprian DD, Schertler GF 10.1038/NATURE09795 2011-03-16 Yes
AA2AR A2A Adenosine A Human X-ray 2YDV 2YDV_refined 2.6 A Active 73 75 - - - - - - NECA
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 2YCY - 3.2 A Inactive 0 60 - - - - - - (S)-Cyanopindolol
small-molecule Antagonist - - Yes No Moukhametzianov R, Warne T, Edwards PC, Serrano-Vega MJ, Leslie AG, Tate CG, Schertler GF 10.1073/PNAS.1100185108 2011-06-08 No
OPSD Rhodopsin Opsins A Japanese flying squid X-ray 3AYN - 2.7 B Inactive 13 77 - - - - - - Retinal (9-cis)
small-molecule Inverse 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 3RFM 3RFM_refined 3.6 A Inactive 1 71 - - - - - - caffeine
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 3VGA - 3.1 A Inactive 1 72 - - - - - - ZM-241385
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 No
AA2AR A2A Adenosine A Human X-ray 3UZA 3UZA_refined 3.3 A Inactive 1 71 - - - - - - compound 4g [PMID: 22220592]
small-molecule Antagonist adenosine small-molecule Yes No Congreve M, Andrews SP, Doré AS, Hollenstein K, Hurrell E, Langmead CJ, Mason JS, Ng IW, Tehan B, Zhukov A, Weir M, Marshall FH. 10.1021/jm201376w 2012-03-21 Yes
OPRM μ Opioid A Mouse X-ray 4DKL 4DKL_refined 2.8 A Inactive 5 71 - - - - T4-Lysozyme - Methyl 4-[[(4R,4aS,7R,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-dihydroxy-1,2,4,5,6,7,7a,13-octahydro-4,12-methanobenzofuro[3,2-e]isoquinolin-7-yl]amino]-4-oxobutanoate
small-molecule Antagonist - - Yes No Manglik A, Kruse AC, Kobilka TS, Thian FS, Mathiesen JM, Sunahara RK, Pardo L, Weis WI, Kobilka BK, Granier S 10.1038/NATURE10954 2012-03-21 Yes
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 4AMI 4AMI_refined 3.2 A Inactive 0 58 - - - - - - Bucindolol
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
small-molecule Inverse agonist (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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
small-molecule Agonist 5-hydroxytryptamine, tryptamine, 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
small-molecule Agonist (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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
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
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
peptide Agonist neurotensin, neuromedin N 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
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
P2Y12 P2Y12 P2Y A Human X-ray 4PY0 4PY0_refined 3.1 A Intermediate 36 83 - - - - BRIL - 2MeSATP
small-molecule Agonist (partial) ADP, ATP small-molecule Yes No Zhang J, Zhang K, Gao ZG, Paoletta S, Zhang D, Han GW, Li T, Ma L, Zhang W, Muller CE, Yang H, Jiang H, Cherezov V, Katritch V, Jacobson KA, Stevens RC, Wu B, Zhao Q 10.1038/NATURE13288 2014-04-30 Yes
SMO SMO Frizzled F Human X-ray 4QIN 4QIN_refined 2.6 A Inactive 12 43 - - - - BRIL - SAG1.5
small-molecule Agonist - - 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 2014-07-23 Yes
ACM3 M3 Acetylcholine (muscarinic) A Rat X-ray 4U15 4U15_refined 2.8 B Inactive 3 47 - - - - T4-Lysozyme - tiotropium
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
OX2R OX2 Orexin A Human X-ray 4S0V 4S0V_refined 2.5 A Inactive 1 64 - - - - Glycogen synthase - suvorexant
small-molecule Antagonist orexin-A, orexin-B peptide Yes No Yin J, Mobarec JC, Kolb P, Rosenbaum DM 10.1038/NATURE14035 2015-01-14 Yes
P2RY1 P2Y1 P2Y A Human X-ray 4XNV - 2.2 A Intermediate 36 78 - - - - Rubredoxin - BMS compound 16 [PMID:23368907]
small-molecule NAM ADP, ATP small-molecule Yes No Zhang D, Gao ZG, Zhang K, Kiselev E, Crane S, Wang J, Paoletta S, Yi C, Ma L, Zhang W, Han GW, Liu H, Cherezov V, Katritch V, Jiang H, Stevens RC, Jacobson KA, Zhao Q, Wu B 10.1038/NATURE14287 2015-04-01 Yes
P2RY1 P2Y1 P2Y A Human X-ray 4XNW 4XNW_refined 2.7 A Intermediate 36 78 - - - - Rubredoxin - MRS2500
small-molecule Antagonist ADP, ATP small-molecule Yes No Zhang D, Gao ZG, Zhang K, Kiselev E, Crane S, Wang J, Paoletta S, Yi C, Ma L, Zhang W, Han GW, Liu H, Cherezov V, Katritch V, Jiang H, Stevens RC, Jacobson KA, Zhao Q, Wu B 10.1038/NATURE14287 2015-04-01 Yes
LPAR1 LPA1 Lysophospholipid (LPA) A Human X-ray 4Z34 4Z34_refined 3.0 A Inactive 1 80 - - - - BRIL - ONO-9780307
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
NTR1 NTS1 Neurotensin A Rat X-ray 4XEE 4XEE_refined 2.9 A Active 83 71 - - - - T4-Lysozyme - neurotensin
peptide Agonist neurotensin, neuromedin N peptide Yes No Krumm BE, White JF, Shah P, Grisshammer R 10.1038/NCOMMS8895 2015-07-29 Yes
GRM5 mGlu5 Metabotropic glutamate C Human X-ray 5CGC 5CGC_refined 3.1 A Inactive 20 20 - - - - T4-Lysozyme - CHEMBL3603915
small-molecule NAM L-glutamic acid small-molecule No No Christopher JA, Aves SJ, Bennett KA, Doré AS, Errey JC, Jazayeri A, Marshall FH, Okrasa K, Serrano-Vega MJ, Tehan BG, Wiggin GR, Congreve M. 10.1021/acs.jmedchem.5b00892 2015-08-12 Yes
AGTR1 AT1 Angiotensin A Human X-ray 4ZUD 4ZUD_refined 2.8 A Inactive 5 75 - - - - BRIL - OLMESARTAN
small-molecule Inverse agonist angiotensin IV, angiotensin II, angiotensin III, angiotensin A peptide Yes No Zhang H, Unal H, Desnoyer R, Han GW, Patel N, Katritch V, Karnik SS, Cherezov V, Stevens RC 10.1074/JBC.M115.689000 2015-10-07 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
small-molecule unknown - - No No Blankenship E, Vahedi-Faridi A, Lodowski DT 10.1016/J.STR.2015.09.015 2015-11-04 Yes
OX1R OX1 Orexin A Human X-ray 4ZJ8 4ZJ8_refined 2.8 A Inactive 1 72 - - - - GlgA glycogen synthase - suvorexant
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
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
ADRB2 β2 Adrenoceptors A Human X-ray 5JQH 5JQH_refined 3.2 A Inactive 0 70 - - - - T4-Lysozyme Nanobody Carazolol
small-molecule Inverse agonist (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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)
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
EDNRB ETB Endothelin A Human X-ray 5GLH 5GLH_refined 2.8 A Inactive 13 66 - - - - T4-Lysozyme - ENDOTHELIN
protein Agonist endothelin-3, endothelin-2, endothelin-1 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 5K2D 5K2D_refined 1.9 A Inactive 1 72 - - - - BRIL - ZM-241385
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
CCR2 CCR2 Chemokine A Human X-ray 5T1A 5T1A_refined 2.8 A Inactive 12 76 - - - - T4-Lysozyme - CCR2-RA-[R]
BMS-681
small-molecule
small-molecule		 Allosteric antagonist
Antagonist		 CCL8, CCL26, CCL24, CCL11, CCL7, CCL2, CCL16, CCL13 peptide No No Zheng Y, Qin L, Zacarias NV, de Vries H, Han GW, Gustavsson M, Dabros M, Zhao C, Cherney RJ, Carter P, Stamos D, Abagyan R, Cherezov V, Stevens RC, IJzerman AP, Heitman LH, Tebben A, Kufareva I, Handel TM 10.1038/NATURE20605 2016-12-14 Yes
AA1R A1 Adenosine A Human X-ray 5UEN 5UEN_refined 3.2 B Inactive 1 91 - - - - BRIL - DU172
small-molecule Antagonist adenosine small-molecule Yes No Glukhova A, Thal DM, Nguyen AT, Vecchio EA, Jorg M, Scammells PJ, May LT, Sexton PM, Christopoulos A 10.1016/j.cell.2017.01.042 2017-03-01 Yes
AGTR2 AT2 Angiotensin A Human X-ray 5UNG 5UNG_refined 2.8 B Active 99 83 - - - - BRIL - compound 1 [PMID: 28379944]
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
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
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
small-molecule Agonist myristic acid, α-linolenic acid, oleic acid, docosahexaenoic 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
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
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
DRD4 D4 Dopamine A Human X-ray 5WIV - 2.1 A Inactive 1 58 - - - - BRIL - [3H]NEMONAPRIDE
small-molecule Antagonist dopamine small-molecule Yes Yes Wang S, Wacker D, Levit A, Che T, Betz RM, McCorvy JD, Venkatakrishnan AJ, Huang XP, Dror RO, Shoichet BK, Roth BL 10.1126/SCIENCE.AAN5468 2017-10-18 Yes
OX2R OX2 Orexin A Human X-ray 5WS3 5WS3_refined 2.3 A Inactive 1 70 - - - - Glycogen synthase - EMPA
small-molecule Antagonist orexin-A, orexin-B peptide Yes No Suno R, Kimura KT, Nakane T, Yamashita K, Wang J, Fujiwara T, Yamanaka Y, Im D, Horita S, Tsujimoto H, Tawaramoto MS, Hirokawa T, Nango E, Tono K, Kameshima T, Hatsui T, Joti Y, Yabashi M, Shimamoto K, Yamamoto M, Rosenbaum DM, Iwata S, Shimamura T, Kobayashi T 10.1016/J.STR.2017.11.005 2017-12-13 Yes
AA2AR A2A Adenosine A Human X-ray 5OLG 5OLG_refined 1.9 A Inactive 1 72 - - - - BRIL - ZM-241385
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
AA2AR A2A Adenosine A Human X-ray 5OLZ 5OLZ_refined 1.9 A Inactive 1 72 - - - - BRIL - CHEMBL2024114
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
OPRK κ Opioid A Human X-ray 6B73 6B73_refined 3.1 A Active 100 73 - - - - BRIL Nanobody MP1104
small-molecule Agonist β-neoendorphin, big dynorphin, dynorphin A-(1-8), dynorphin A-(1-13), α-neoendorphin, β-endorphin, dynorphin B, dynorphin A peptide Yes No Che T, Majumdar S, Zaidi SA, Ondachi P, McCorvy JD, Wang S, Mosier PD, Uprety R, Vardy E, Krumm BE, Han GW, Lee MY, Pardon E, Steyaert J, Huang XP, Strachan RT, Tribo AR, Pasternak GW, Carroll FI, Stevens RC, Cherezov V, Katritch V, Wacker D, Roth BL 10.1016/J.CELL.2017.12.011 2018-01-17 Yes
5HT2C 5-HT2C 5-Hydroxytryptamine A Human X-ray 6BQH 6BQH_refined 2.7 A Inactive 1 63 - - - - BRIL - ritanserin
small-molecule Inverse 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
GRM5 mGlu5 Metabotropic glutamate C Human X-ray 6FFH 6FFH_refined 2.7 A Inactive 20 21 - - - - T4-Lysozyme - fenobam
small-molecule NAM L-glutamic acid small-molecule No No Christopher JA, Orgovan Z, Congreve M, Dore AS, Errey JC, Marshall FH, Mason JS, Okrasa K, Rucktooa P, Serrano-Vega MJ, Ferenczy GG, Keseru GM 10.1021/ACS.JMEDCHEM.7B01722 2018-03-07 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 6FK6 6FK6_refined 2.4 A Active 99 94 - - - - - - COMPOUND SUMMARY
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 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
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
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
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
C5AR1 C5a1 Complement peptide A Human X-ray 6C1R 6C1R_refined 2.2 B Inactive 6 83 - - - - BRIL - PMX53
avacopan
peptide
small-molecule		 Antagonist
NAM		 C5a des-Arg, C3a, ribosomal protein S19, C5a peptide Yes No Liu H, Kim HR, Deepak RNVK, Wang L, Chung KY, Fan H, Wei Z, Zhang C 10.1038/S41594-018-0067-Z 2018-05-30 Yes
PTAFR PAF Platelet-activating factor A Human X-ray 5ZKP 5ZKP_refined 2.8 A Other - 85 - - - - Flavodoxin - foropafant
small-molecule Antagonist 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
PTAFR PAF Platelet-activating factor A Human X-ray 5ZKQ 5ZKQ_refined 2.9 B Intermediate 36 83 - - - - T4-Lysozyme - ABT-491
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
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
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
small-molecule Antagonist PGD3, PGD2, PGI2, PGE2, PGJ2, thromboxane A2, PGF2α 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
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
small-molecule Antagonist CCL8, CCL4, CCL11, CCL7, CCL14, CCL2, CCL3, CCL16, CCL5, CCL13 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
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
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
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
small-molecule Agonist PGD2, PGI2, PGE1, PGE2, thromboxane A2, PGF2α 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
small-molecule Antagonist PGH2, PGD2, PGI2, PGE2, thromboxane A2, PGF2α 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
small-molecule Antagonist CCL8, CCL26, CCL24, CCL11, CCL7, CCL2, CCL16, CCL13 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
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
small-molecule Antagonist neuropeptide-γ, hemokinin 1, neurokinin B, neuropeptide K, neurokinin A, substance P 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 - - 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 synthetic)
small-molecule Agonist adrenomedullin, α-CGRP, calcitonin (salmon), adrenomedullin 2/intermedin, amylin, calcitonin, β-CGRP 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
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
small-molecule Antagonist 5-hydroxytryptamine, tryptamine 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
small-molecule Antagonist neuropeptide-γ, hemokinin 1, neurokinin B, neuropeptide K, neurokinin A, substance P 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 PTHrP-(1-36), TIP39, PTH, 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
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
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
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
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
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
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
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
small-molecule Agonist (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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
AA2AR A2A Adenosine A Human X-ray 6GT3 6GT3_refined 2.0 A Inactive 1 72 - - - - BRIL - imaradenant
small-molecule Antagonist adenosine small-molecule Yes Yes - - 2019-06-26 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 6N48 6N48_refined 3.2 A Active 100 70 - - - - T4-Lysozyme Camelid Antibody Fragment BI-167107
2-[[(3R)-4-(4-Tert-butylphenyl)-3-[[2-(4-methoxyphenyl)sulfanyl-5-[methyl(propan-2-yl)sulfamoyl]benzoyl]amino]butanoyl]amino]acetic acid
small-molecule
small-molecule		 Agonist
PAM		 (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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 6OS9 6OS9_refined 3.0 R Active 100 73 Gi/o αi1 - 62 - scFv16 JMV449
peptide Agonist neurotensin, large neurotensin, large neuromedin N, 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 6OY9 6OY9_refined 3.9 R Active 100 94 Gi/o αt1 - 64 - - Retinal (all-trans)
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
OPSD Rhodopsin Opsins A Bovine cryo-EM 6OFJ 6OFJ_refined 4.5 A Inactive 22 93 - - - - - - Apo (no ligand)
none Apo (no ligand) - - No No Zhao DY, Poge M, Morizumi T, Gulati S, Van Eps N, Zhang J, Miszta P, Filipek S, Mahamid J, Plitzko JM, Baumeister W, Ernst OP, Palczewski K 10.1074/JBC.RA119.010089 2019-08-21 Yes
CLTR1 CysLT1 Leukotriene A Human X-ray 6RZ4 6RZ4_refined 2.7 A Intermediate 36 85 - - - - BRIL - pranlukast
small-molecule Antagonist LTE4, LTC4, LTD4 small-molecule Yes Yes Luginina A, Gusach A, Marin E, Mishin A, Brouillette R, Popov P, Shiriaeva A, Besserer-Offroy E, Longpre JM, Lyapina E, Ishchenko A, Patel N, Polovinkin V, Safronova N, Bogorodskiy A, Edelweiss E, Hu H, Weierstall U, Liu W, Batyuk A, Gordeliy V, Han GW, Sarret P, Katritch V, Borshchevskiy V, Cherezov V 10.1126/SCIADV.AAX2518 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
small-molecule NAM glucagon, glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide 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 6PS1 6PS1_refined 3.2 A Inactive 0 68 - - - - T4-Lysozyme - timolol
small-molecule Antagonist (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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 6PS5 6PS5_refined 2.9 A Inactive 0 68 - - - - T4-Lysozyme - propranolol
small-molecule Antagonist (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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 cryo-EM 6NI3 6NI3_refined 3.8 R Active 100 69 Gs αs - 59 - Nanobody-35 BI-167107
small-molecule Agonist (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline small-molecule Yes No Nguyen AH, Thomsen ARB, Cahill TJ 3rd, Huang R, Huang LY, Marcink T, Clarke OB, Heissel S, Masoudi A, Ben-Hail D, Samaan F, Dandey VP, Tan YZ, Hong C, Mahoney JP, Triest S, Little J 4th, Chen X, Sunahara R, Steyaert J, Molina H, Yu Z, des Georges A, Lefkowitz RJ 10.1038/S41594-019-0330-Y 2019-11-20 Yes
ACM5 M5 Acetylcholine (muscarinic) A Human X-ray 6OL9 6OL9_refined 2.5 A Inactive 3 53 - - - - T4-Lysozyme - tiotropium
small-molecule Inverse agonist acetylcholine small-molecule No No Vuckovic Z, Gentry PR, Berizzi AE, Hirata K, Varghese S, Thompson G, van der Westhuizen ET, Burger WAC, Rahmani R, Valant C, Langmead CJ, Lindsley CW, Baell JB, Tobin AB, Sexton PM, Christopoulos A, Thal DM 10.1073/PNAS.1914446116 2019-12-11 Yes
CLTR2 CysLT2 Leukotriene A Human X-ray 6RZ7 6RZ7_refined 2.4 A Intermediate 36 79 - - - - BRIL - ONO-2570366
small-molecule Antagonist LTE4, LTC4, LTD4 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 6TOD - 2.1 A Inactive 1 71 - - - - - - EMPA
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 6TPG 6TPG_refined 2.7 A Inactive 1 69 - - - - GlgA glycogen synthase - EMPA
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 6TQ4 6TQ4_refined 2.3 B Inactive 1 70 - - - - - - CHEMBL4590386
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
GLP1R GLP-1 Glucagon B1 Human cryo-EM 6ORV - 3.0 E Active 100 61 Gs αs - 48 - Nanobody-35 CHEMBL3950796
small-molecule Agonist glucagon, glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide peptide No No Zhao P, Liang YL, Belousoff MJ, Deganutti G, Fletcher MM, Willard FS, Bell MG, Christe ME, Sloop KW, Inoue A, Truong TT, Clydesdale L, Furness SGB, Christopoulos A, Wang MW, Miller LJ, Reynolds CA, Danev R, Sexton PM, Wootten D 10.1038/s41586-019-1902-z 2020-01-08 Yes
APJ apelin Apelin A Human X-ray 6KNM 6KNM_refined 3.2 B Inactive 5 78 - - - - Rubredoxin - Single domain antibody JN241
protein Agonist apelin-36, Elabela/Toddler-21, apelin-13, Elabela/Toddler-32, apelin-17, [Pyr1]apelin-13, apelin receptor early endogenous ligand, Elabela/Toddler-11 peptide Yes No Ma Y, Ding Y, Song X, Ma X, Li X, Zhang N, Song Y, Sun Y, Shen Y, Zhong W, Hu LA, Ma Y, Zhang MY 10.1126/SCIADV.AAX7379 2020-01-29 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 6NWE 6NWE_refined 2.7 A Active 100 94 Gi/o αt1 Only H5 3 - - B-Octylglucoside
small-molecule unknown - - No No - - 2020-02-12 Yes
CRFR2 CRF2 Corticotropin-releasing factor B1 Human cryo-EM 6PB1 6PB1_refined 2.8 P Active 100 68 Gs αs - 58 - Nanobody-35 CHEMBL427807
protein Agonist urocortin 2, corticotrophin-releasing hormone, urocortin 1, urocortin 3 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 6LI1 6LI1_refined 2.9 A Inactive 32 81 - - - - Flavodoxin - Apo (no ligand)
none Apo (no ligand) - - 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
ACM2 M2 Acetylcholine (muscarinic) A Human cryo-EM 6U1N 6U1N_refined 4.0 R Active 100 57 Beta Beta-arrestin-1 - 86 - Fab30 light chain
Fab30 heavy chain		 LY2119620
small-molecule Agonist acetylcholine small-molecule Yes No Staus DP, Hu H, Robertson MJ, Kleinhenz ALW, Wingler LM, Capel WD, Latorraca NR, Lefkowitz RJ, Skiniotis G 10.1038/S41586-020-1954-0 2020-02-26 Yes
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 2Y02 2Y02_refined 2.6 B Inactive 0 62 - - - - - - CARMOTEROL
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
OPSD Rhodopsin Opsins A Bovine X-ray 3OAX - 2.6 A Inactive 22 100 - - - - - - Retinal (11-cis)
small-molecule Inverse agonist - - No No Makino CL, Riley CK, Looney J, Crouch RK, Okada T 10.1016/J.BPJ.2010.08.003 2011-01-19 No
AA2AR A2A Adenosine A Human X-ray 3QAK 3QAK_refined 2.7 A Active 73 69 - - - - T4-Lysozyme - UK-432,097
small-molecule Agonist adenosine small-molecule Yes No Xu F, Wu H, Katritch V, Han GW, Jacobson KA, Gao ZG, Cherezov V, Stevens RC 10.1126/SCIENCE.1202793 2011-03-09 Yes
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 2YCW 2YCW_refined 3.0 A Inactive 0 61 - - - - - - Carazolol
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
HRH1 H1 Histamine A Human X-ray 3RZE 3RZE_refined 3.1 A Inactive 3 55 - - - - T4-Lysozyme - doxepin
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
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
OPSD Rhodopsin Opsins A Bovine X-ray 4A4M 4A4M_refined 3.3 A Active 100 94 Gi/o αt1 Only H5 3 - - Retinal (all-trans)
small-molecule Agonist - - No No Deupi X, Edwards P, Singhal A, Nickle B, Oprian D, Schertler G, Standfuss J 10.1073/PNAS.1114089108 2012-01-25 Yes
S1PR1 S1P1 Lysophospholipid (S1P) A Human X-ray 3V2W - 3.4 A Inactive 1 68 - - - - T4-Lysozyme - W146
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 No
AA2AR A2A Adenosine A Human X-ray 3UZC 3UZC_refined 3.3 A Inactive 1 71 - - - - - - CHEMBL2024114
small-molecule Antagonist adenosine small-molecule Yes No Congreve M, Andrews SP, Doré AS, Hollenstein K, Hurrell E, Langmead CJ, Mason JS, Ng IW, Tehan B, Zhukov A, Weir M, Marshall FH. 10.1021/jm201376w 2012-03-21 Yes
OPRX NOP Opioid A Human X-ray 4EA3 4EA3_refined 3.0 A Inactive 5 75 - - - - BRIL - compound 24 [PMID: 16451050]
small-molecule Antagonist nociceptin/orphanin FQ peptide Yes No Thompson AA, Liu W, Chun E, Katritch V, Wu H, Vardy E, Huang XP, Trapella C, Guerrini R, Calo G, Roth BL, Cherezov V, Stevens RC 10.1038/NATURE11085 2012-04-25 Yes
AA2AR A2A Adenosine A Human X-ray 4EIY 4EIY_refined 1.8 A Inactive 1 72 - - - - BRIL - ZM-241385
small-molecule Antagonist adenosine small-molecule Yes Yes Liu W, Chun E, Thompson AA, Chubukov P, Xu F, Katritch V, Han GW, Roth CB, Heitman LH, IJzerman AP, Cherezov V, Stevens RC 10.1126/SCIENCE.1219218 2012-07-25 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
5HT2B 5-HT2B 5-Hydroxytryptamine A Human X-ray 4IB4 4IB4_refined 2.7 A Intermediate 36 59 - - - - BRIL - ergotamine
small-molecule Agonist 5-hydroxytryptamine small-molecule Yes No Wacker D, Wang C, Katritch V, Han GW, Huang XP, Vardy E, McCorvy JD, Jiang Y, Chu M, Siu FY, Liu W, Xu HE, Cherezov V, Roth BL, Stevens RC 10.1126/science.1232808 2013-03-13 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
small-molecule Antagonist CCL8, CCL4, CCL11, CCL7, CCL14, CCL2, CCL3, CCL16, CCL5, CCL13 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
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
5HT2B 5-HT2B 5-Hydroxytryptamine A Human X-ray 4NC3 4NC3_refined 2.8 A Intermediate 36 60 - - - - BRIL - ergotamine
small-molecule Agonist 5-hydroxytryptamine small-molecule Yes No Liu W, Wacker D, Gati C, Han GW, James D, Wang D, Nelson G, Weierstall U, Katritch V, Barty A, Zatsepin NA, Li D, Messerschmidt M, Boutet S, Williams GJ, Koglin JE, Seibert MM, Wang C, Shah ST, Basu S, Fromme R, Kupitz C, Rendek KN, Grotjohann I, Fromme P, Kirian RA, Beyerlein KR, White TA, Chapman HN, Caffrey M, Spence JC, Stevens RC, Cherezov V 10.1126/SCIENCE.1244142 2013-12-18 Yes
NTR1 NTS1 Neurotensin A Rat X-ray 4BV0 - 3.1 A Inactive 2 70 - - - - - - neurotensin
peptide Agonist neurotensin, neuromedin N 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
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
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
small-molecule Agonist (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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
OPRD δ Opioid A Human X-ray 4RWA 4RWA_refined 3.3 A Inactive 5 77 - - - - BRIL - DIPP-NH2
peptide Antagonist [Leu]enkephalin, β-endorphin, dynorphin A-(1-8), dynorphin A-(1-13), endomorphin-1, dynorphin B, dynorphin A 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 - 2.9 A Active 99 82 - - - - - Nanobody CX3CL1
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
AA2AR A2A Adenosine A Human X-ray 4UHR 4UHR_refined 2.6 A Active 73 75 - - - - - - CGS 21680
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
LPAR1 LPA1 Lysophospholipid (LPA) A Human X-ray 4Z35 4Z35_refined 2.9 A Inactive 1 80 - - - - BRIL - ONO-9910539
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
NTR1 NTS1 Neurotensin A Rat X-ray 4XES 4XES_refined 2.6 A Active 83 72 - - - - T4-Lysozyme - neurotensin
peptide Agonist neurotensin, neuromedin N peptide Yes No Krumm BE, White JF, Shah P, Grisshammer R 10.1038/NCOMMS8895 2015-07-29 Yes
GRM5 mGlu5 Metabotropic glutamate C Human X-ray 5CGD 5CGD_refined 2.6 A Inactive 20 20 - - - - T4-Lysozyme - CHEMBL3603923
small-molecule NAM L-glutamic acid small-molecule No No Christopher JA, Aves SJ, Bennett KA, Doré AS, Errey JC, Jazayeri A, Marshall FH, Okrasa K, Serrano-Vega MJ, Tehan BG, Wiggin GR, Congreve M. 10.1021/acs.jmedchem.5b00892 2015-08-12 Yes
OPRX NOP Opioid A Human X-ray 5DHG 5DHG_refined 3.0 A Inactive 5 76 - - - - BRIL - CHEMBL1783826
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
ADRB2 β2 Adrenoceptors A Human X-ray 5D5A 5D5A_refined 2.5 A Inactive 0 68 - - - - T4-Lysozyme - Carazolol
small-molecule Inverse agonist (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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
ACM4 M4 Acetylcholine (muscarinic) A Human X-ray 5DSG 5DSG_refined 2.6 B Inactive 3 60 - - - - T4-Lysozyme - tiotropium
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 5IU4 5IU4_refined 1.7 A Inactive 1 71 - - - - BRIL - ZM-241385
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
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
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
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-3, endothelin-2, endothelin-1 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 5K2B 5K2B_refined 2.5 A Inactive 1 72 - - - - BRIL - ZM-241385
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
CCR9 CCR9 Chemokine A Human X-ray 5LWE - 2.8 B Inactive 52 67 - - - - - - vercirnon
small-molecule Allosteric antagonist CCL25 peptide No No Oswald C, Rappas M, Kean J, Dore AS, Errey JC, Bennett K, Deflorian F, Christopher JA, Jazayeri A, Mason JS, Congreve M, Cooke RM, Marshall FH 10.1038/NATURE20606 2016-12-07 Yes
5HT2B 5-HT2B 5-Hydroxytryptamine A Human X-ray 5TVN 5TVN_refined 2.9 A Intermediate 36 61 - - - - BRIL - Lysergide
small-molecule Agonist 5-hydroxytryptamine small-molecule Yes No Wacker D, Wang S, McCorvy JD, Betz RM, Venkatakrishnan AJ, Levit A, Lansu K, Schools ZL, Che T, Nichols DE, Shoichet BK, Dror RO, Roth BL 10.1016/J.CELL.2016.12.033 2017-02-01 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 5TE3 5TE3_refined 2.7 A Active 99 94 - - - - - - B-Octylglucoside
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
PAR2 PAR2 Proteinase-activated A Human X-ray 5NDD 5NDD_refined 2.8 A Intermediate 36 74 - - - - BRIL - AZ8838
small-molecule 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
CALCR CT Calcitonin B1 Human cryo-EM 5UZ7 5UZ7_refined 4.1 R Active 100 56 Gs αs - 47 - - - - - adrenomedullin, α-CGRP, calcitonin (salmon), adrenomedullin 2/intermedin, amylin, calcitonin, β-CGRP peptide No No Liang YL, Khoshouei M, Radjainia M, Zhang Y, Glukhova A, Tarrasch J, Thal DM, Furness SGB, Christopoulos G, Coudrat T, Danev R, Baumeister W, Miller LJ, Christopoulos A, Kobilka BK, Wootten D, Skiniotis G, Sexton PM 10.1038/NATURE22327 2017-05-03 Yes
GLP1R GLP-1 Glucagon B1 Human X-ray 5VEW 5VEW_refined 2.7 A Inactive 0 57 - - - - T4-Lysozyme - PF-06372222
small-molecule NAM glucagon, glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide 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
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 - 3.7 A Intermediate 31 84 - - - - - - Truncated protein agonist
peptide Agonist glucagon, glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide 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
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
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-3, endothelin-2, endothelin-1 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
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
OPSD Rhodopsin Opsins A Bovine X-ray 5WKT 5WKT_refined 3.2 A Active 100 94 Gi/o αt1 Only H5 3 - - B-Octylglucoside
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
small-molecule Antagonist C5a des-Arg, C3a, ribosomal protein S19, C5a 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
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
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
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, glucagon-like peptide 1-(7-37), glucagon-like peptide 1-(7-36) amide 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 6FKB 6FKB_refined 3.0 A Active 99 94 - - - - - - 2-(4-Chlorophenyl)-1-spiro[1,3-benzodioxole-2,4'-piperidine]-1'-yl-ethanone
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
NPY1R Y1 Neuropeptide Y A Human X-ray 5ZBQ 5ZBQ_refined 2.7 A Inactive 1 80 - - - - T4-Lysozyme - CHEMBL3747822
small-molecule Antagonist pancreatic polypeptide, peptide YY, neuropeptide Y peptide Yes No Yang Z, Han S, Keller M, Kaiser A, Bender BJ, Bosse M, Burkert K, Kogler LM, Wifling D, Bernhardt G, Plank N, Littmann T, Schmidt P, Yi C, Li B, Ye S, Zhang R, Xu B, Larhammar D, Stevens RC, Huster D, Meiler J, Zhao Q, Beck-Sickinger AG, Buschauer A, Wu B 10.1038/S41586-018-0046-X 2018-04-25 Yes
Q98SW5 SMO Frizzled F African clawed frog X-ray 6D35 6D35_refined 3.9 A Active 87 58 - - - - BRIL - Cholesterol
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
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
OPSD Rhodopsin Opsins A Human cryo-EM 6CMO 6CMO_refined 4.5 R Active 80 92 Gi/o αi1 - 100 BRIL Fab Apo (no ligand)
none Apo (no ligand) - - No No Kang Y, Kuybeda O, de Waal PW, Mukherjee S, Van Eps N, Dutka P, Zhou XE, Bartesaghi A, Erramilli S, Morizumi T, Gu X, Yin Y, Liu P, Jiang Y, Meng X, Zhao G, Melcher K, Ernst OP, Kossiakoff AA, Subramaniam S, Xu HE 10.1038/S41586-018-0215-Y 2018-06-20 Yes
5HT2B 5-HT2B 5-Hydroxytryptamine A Human X-ray 6DRY 6DRY_refined 2.9 A Intermediate 36 60 - - - - BRIL - methylergonovine
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
small-molecule Antagonist PGD3, PGD2, PGI2, PGE2, PGJ2, thromboxane A2, PGF2α 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
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 6H7N 6H7N_refined 2.5 A Active 100 60 - - - - Thioredoxin 1 Camelid antibody fragment Nb6B9 (S)-Xamoterol
small-molecule Agonist - - Yes No - 10.1101/436212 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
small-molecule Agonist (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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
PTH1R PTH1 Parathyroid hormone B1 Human X-ray 6FJ3 - 2.5 A Inactive 0 62 - - - - GlgA glycogen synthase - ePTH
peptide Agonist (partial) PTHrP-(1-36), TIP39, PTH, PTHrP peptide No No Ehrenmann J, Schoppe J, Klenk C, Rappas M, Kummer L, Dore AS, Pluckthun A 10.1038/S41594-018-0151-4 2018-11-21 Yes
PE2R4 EP4 Prostanoid A Human X-ray 5YWY 5YWY_refined 3.2 A Inactive 10 57 - - - - - Fab ONO-AE3-208
small-molecule Antagonist PGD2, PGI2, PGE1, PGE2, thromboxane A2, PGF2α 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
CCR5 CCR5 Chemokine A Human cryo-EM 6MEO 6MEO_refined 3.9 B Inactive 12 89 - - - - - T-cell surface glycoprotein CD4 Envelope glycoprotein gp160
protein Antagonist CCL8, CCL4, CCL11, CCL7, CCL14, CCL2, CCL3, CCL16, CCL5, CCL13 peptide No No Shaik MM, Peng H, Lu J, Rits-Volloch S, Xu C, Liao M, Chen B 10.1038/S41586-018-0804-9 2018-12-12 Yes
B1B1U5 Rhodopsin Opsins A Hasarius adansoni X-ray 6I9K - 2.2 A Inactive 13 83 - - - - - - Retinal (11-cis)
small-molecule Inverse agonist - - Yes No Varma N, Mutt E, Muhle J, Panneels V, Terakita A, Deupi X, Nogly P, Schertler GFX, Lesca E 10.1073/PNAS.1902192116 2019-07-03 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
peptide Agonist neurotensin, large neurotensin, large neuromedin N, 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)
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
CCR7 CCR7 Chemokine A Human X-ray 6QZH 6QZH_refined 2.1 A Inactive 5 71 - - - - Sialidase NanA - SCHEMBL13407377
small-molecule Allosteric antagonist Ccl21b, CCL21, CCL19 peptide No No Jaeger K, Bruenle S, Weinert T, Guba W, Muehle J, Miyazaki T, Weber M, Furrer A, Haenggi N, Tetaz T, Huang CY, Mattle D, Vonach JM, Gast A, Kuglstatter A, Rudolph MG, Nogly P, Benz J, Dawson RJP, Standfuss J 10.1016/J.CELL.2019.07.028 2019-09-04 Yes
CLTR1 CysLT1 Leukotriene A Human X-ray 6RZ5 6RZ5_refined 2.5 B Intermediate 36 84 - - - - BRIL - zafirlukast
small-molecule Antagonist LTE4, LTC4, LTD4 small-molecule Yes Yes Luginina A, Gusach A, Marin E, Mishin A, Brouillette R, Popov P, Shiriaeva A, Besserer-Offroy E, Longpre JM, Lyapina E, Ishchenko A, Patel N, Polovinkin V, Safronova N, Bogorodskiy A, Edelweiss E, Hu H, Weierstall U, Liu W, Batyuk A, Gordeliy V, Han GW, Sarret P, Katritch V, Borshchevskiy V, Cherezov V 10.1126/SCIADV.AAX2518 2019-10-30 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 6PRZ 6PRZ_refined 2.8 A Inactive 0 68 - - - - T4-Lysozyme - CHEMBL1160734
small-molecule Antagonist (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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 6PS3 6PS3_refined 2.5 A Inactive 0 68 - - - - T4-Lysozyme - CHEMBL3799125
small-molecule Antagonist (-)-noradrenaline, L-NOREPINEPHRINE, noradrenaline, Zn2+, (-)-adrenaline 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
AA2AR A2A Adenosine A Human X-ray 6PS7 6PS7_refined 1.9 A Inactive 1 72 - - - - BRIL - ZM-241385
small-molecule Antagonist adenosine small-molecule Yes Yes 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
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 [Leu]enkephalin, β-endorphin, dynorphin A-(1-8), dynorphin A-(1-13), endomorphin-1, dynorphin B, dynorphin A 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 6RZ9 6RZ9_refined 2.7 A Intermediate 36 81 - - - - BRIL - ONO-2770372
small-molecule Antagonist LTE4, LTC4, LTD4 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 6TP4 - 3.0 A Inactive 1 70 - - - - - - ACT-462206
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
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
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.