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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 21 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 21 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 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 1L9H - 2.6 A Inactive 21 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 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 1GZM 1GZM_refined 2.7 A Inactive 21 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 21 100 - - - - - - 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 21 100 - - - - - - Retinal (all-trans)
small-molecule Agonist - - No No Nakamichi H, Okada T 10.1073/PNAS.0601765103 2006-08-22 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 2G87 2G87_refined 2.6 A Inactive 21 100 - - - - - - Retinal (all-trans)
small-molecule Agonist - - No No Nakamichi H, Okada T 10.1002/ANIE.200600595 2006-09-02 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 2I35 - 3.8 A Inactive 21 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 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 2I36 - 4.1 A Inactive 21 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 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 2J4Y - 3.4 B Inactive 21 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 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 2RH1 - 2.4 A Inactive 0 68 - - - - T4-Lysozyme - Carazolol
small-molecule Inverse agonist (-)-noradrenaline, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, 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 2R4S 2R4S_refined 3.4 A Inactive 1 52 - - - - - Antibody - - - (-)-noradrenaline, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, 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 Yes
OPSD Rhodopsin Opsins A Japanese flying squid X-ray 2Z73 2Z73_refined 2.5 A Inactive 16 78 - - - - - - Retinal (11-cis)
small-molecule Inverse agonist - - Yes No Murakami M, Kouyama T 10.1038/NATURE06925 2008-05-13 Yes
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 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 3C9M - 3.4 A Inactive 21 94 - - - - - - Retinal (11-cis)
small-molecule Inverse agonist - - No No Stenkamp RE 10.1107/S0907444908017162 2008-08-05 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 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 3NY8 3NY8_refined 2.8 A Inactive 0 67 - - - - T4-Lysozyme - ICI 118551
small-molecule Inverse agonist (-)-noradrenaline, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, 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
small-molecule Antagonist (-)-noradrenaline, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, 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 3OE0 - 2.9 A Inactive 4 78 - - - - T4-Lysozyme - CVX15
peptide Antagonist CXCL12γ, CXCL12, CXCL12α, CXCL12δ, CXCL12ε, CXCL12φ, CXCL12β 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 3OE8 3OE8_refined 3.1 A Inactive 4 76 - - - - T4-Lysozyme - isothiourea-1t
small-molecule Antagonist CXCL12γ, CXCL12, CXCL12α, CXCL12δ, CXCL12ε, CXCL12φ, CXCL12β 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
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 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
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 2Y04 2Y04_refined 3.1 B Inactive 0 62 - - - - - - levosalbutamol
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
OPSD Rhodopsin Opsins A Bovine X-ray 3OAX - 2.6 A Inactive 21 100 - - - - - - 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 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
AA2AR A2A Adenosine A Human X-ray 3QAK 3QAK_refined 2.7 A Active 67 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 2Y01 - 2.6 A Inactive 0 59 - - - - - - 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 2011-03-30 Yes
AA2AR A2A Adenosine A Human X-ray 2YDV 2YDV_refined 2.6 A Active 67 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 2YCX - 3.3 A Inactive 0 59 - - - - - - (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 2011-06-01 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 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 3SN6 - 3.2 R Active 100 69 Gs αs - 89 T4-Lysozyme Antibody CHEMBL1615159
small-molecule Agonist (-)-noradrenaline, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ small-molecule Yes No Rasmussen SG, DeVree BT, Zou Y, Kruse AC, Chung KY, Kobilka TS, Thian FS, Chae PS, Pardon E, Calinski D, Mathiesen JM, Shah ST, Lyons JA, Caffrey M, Gellman SH, Steyaert J, Skiniotis G, Weis WI, Sunahara RK, Kobilka BK 10.1038/NATURE10361 2011-07-20 Yes
AA2AR A2A Adenosine A Human X-ray 3PWH 3PWH_refined 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 Yes
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
ACM2 M2 Acetylcholine (muscarinic) A Human X-ray 3UON 3UON_refined 3.0 A Inactive 2 60 - - - - T4-Lysozyme - CHEMBL558910
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
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 Yes
S1PR1 S1P1 Lysophospholipid (S1P) A Human X-ray 3V2Y 3V2Y_refined 2.8 A Inactive 1 76 - - - - T4-Lysozyme - W146
small-molecule Antagonist dihydrosphingosine 1-phosphate, sphingosine 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
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
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
OPRM μ Opioid A Mouse X-ray 4DKL 4DKL_refined 2.8 A Inactive 4 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
OPRX NOP Opioid A Human X-ray 4EA3 4EA3_refined 3.0 A Inactive 4 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
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 4AMJ 4AMJ_refined 2.3 B Inactive 0 62 - - - - - - CHEMBL3799125
small-molecule Inverse agonist - - Yes No Warne T, Edwards PC, Leslie AG, Tate CG 10.1016/J.STR.2012.03.014 2012-05-23 Yes
NTR1 NTS1 Neurotensin A Rat X-ray 4GRV 4GRV_refined 2.8 A Active 87 69 - - - - T4-Lysozyme - JMV431
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
PAR1 PAR1 Proteinase-activated A Human X-ray 3VW7 3VW7_refined 2.2 A Intermediate 41 66 - - - - T4-Lysozyme - vorapaxar
small-molecule Antagonist thrombin peptide Yes No Zhang C, Srinivasan Y, Arlow DH, Fung JJ, Palmer D, Zheng Y, Green HF, Pandey A, Dror RO, Shaw DE, Weis WI, Coughlin SR, Kobilka BK 10.1038/NATURE11701 2012-12-12 Yes
5HT1B 5-HT1B 5-Hydroxytryptamine A Human X-ray 4IAQ 4IAQ_refined 2.8 A Inactive 14 70 - - - - BRIL - dihydroergotamine
small-molecule Agonist tryptamine, 5-HT-moduline, 5-hydroxytryptamine 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
5HT2B 5-HT2B 5-Hydroxytryptamine A Human X-ray 4IB4 4IB4_refined 2.7 A Intermediate 41 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
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 3ZPR 3ZPR_refined 2.7 B Inactive 0 61 - - - - - - CHEMBL1559535
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
SMO SMO Frizzled F Human X-ray 4JKV 4JKV_refined 2.5 A Inactive 0 44 - - - - BRIL - taladegib
small-molecule Antagonist - - No No Wang C, Wu H, Katritch V, Han GW, Huang XP, Liu W, Siu FY, Roth BL, Cherezov V, Stevens RC 10.1038/NATURE12167 2013-04-24 Yes
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
CCR5 CCR5 Chemokine A Human X-ray 4MBS 4MBS_refined 2.7 A Inactive 15 83 - - - - Rubredoxin - maraviroc
small-molecule Antagonist CCL13, CCL11, CCL7, CCL3, CCL8, CCL16, CCL4, CCL2, CCL5, CCL14 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
ADRB2 β2 Adrenoceptors A Human X-ray 4LDL 4LDL_refined 3.1 A Active 99 69 - - - - T4-Lysozyme Nanobody hydroxybenzylisoproterenol
small-molecule Agonist (-)-noradrenaline, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, 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 99 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
5HT2B 5-HT2B 5-Hydroxytryptamine A Human X-ray 4NC3 4NC3_refined 2.8 A Intermediate 41 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
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 4BUO 4BUO_refined 2.8 A Inactive 3 72 - - - - - - neurotensin
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 Yes
NTR1 NTS1 Neurotensin A Rat X-ray 4BWB - 3.6 A Inactive 3 72 - - - - - - neurotensin
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 Yes
GRM1 mGlu1 Metabotropic glutamate C Human X-ray 4OR2 4OR2_refined 2.8 B Inactive - 22 - - - - BRIL - FITM
small-molecule NAM L-glutamic acid small-molecule No No Wu H, Wang C, Gregory KJ, Han GW, Cho HP, Xia Y, Niswender CM, Katritch V, Meiler J, Cherezov V, Conn PJ, Stevens RC 10.1126/science.1249489 2014-03-19 Yes
P2Y12 P2Y12 P2Y A Human X-ray 4NTJ 4NTJ_refined 2.6 A Intermediate 41 78 - - - - BRIL - AZD1283
small-molecule Antagonist ATP, ADP 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
P2Y12 P2Y12 P2Y A Human X-ray 4PY0 4PY0_refined 3.1 A Intermediate 41 83 - - - - BRIL - 2MeSATP
small-molecule Agonist (partial) ATP, ADP 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
FFAR1 FFA1 Free fatty acid A Human X-ray 4PHU 4PHU_refined 2.3 A Intermediate 41 90 - - - - T4-Lysozyme - fasiglifam
small-molecule Allosteric agonist myristic acid, α-linolenic acid, oleic acid, docosahexaenoic 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
SMO SMO Frizzled F Human X-ray 4QIN 4QIN_refined 2.6 A Inactive 11 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
OPSD Rhodopsin Opsins A Bovine X-ray 4PXF 4PXF_refined 2.8 A Active 100 93 Visual S-arrestin Fragment 2 - - B-Octylglucoside
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
ACM3 M3 Acetylcholine (muscarinic) A Rat X-ray 4U14 4U14_refined 3.6 A Inactive 2 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
ACM3 M3 Acetylcholine (muscarinic) A Rat X-ray 4U16 4U16_refined 3.7 B Inactive 2 47 - - - - T4-Lysozyme - N-methyl scopolamine
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
OPRD δ Opioid A Human X-ray 4RWD 4RWD_refined 2.7 A Inactive 4 79 - - - - BRIL - DIPP-NH2
peptide Antagonist dynorphin A, [Leu]enkephalin, endomorphin-1, dynorphin B, dynorphin A-(1-8), β-endorphin, α-neoendorphin, [Met]enkephalin, dynorphin A-(1-13) peptide Yes Yes 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
CXCR4 CXCR4 Chemokine A Human X-ray 4RWS 4RWS_refined 3.1 A Inactive 4 78 - - - - T4-Lysozyme - vMIP-II
peptide Antagonist CXCL12γ, CXCL12, CXCL12α, CXCL12δ, CXCL12ε, CXCL12φ, CXCL12β 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
P2RY1 P2Y1 P2Y A Human X-ray 4XNV - 2.2 A Intermediate 41 78 - - - - Rubredoxin - BMS compound 16 [PMID:23368907]
small-molecule NAM ATP, ADP 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 41 78 - - - - Rubredoxin - MRS2500
small-molecule Antagonist ATP, ADP 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
AA2AR A2A Adenosine A Human X-ray 4UHR 4UHR_refined 2.6 A Active 67 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 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
LPAR1 LPA1 Lysophospholipid (LPA) A Human X-ray 4Z36 4Z36_refined 2.9 A Inactive 1 79 - - - - BRIL - ONO-3080573
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 87 71 - - - - T4-Lysozyme - neurotensin
peptide Agonist neuromedin N, neurotensin peptide Yes No Krumm BE, White JF, Shah P, Grisshammer R 10.1038/NCOMMS8895 2015-07-29 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
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 5A8E 5A8E_refined 2.4 A Inactive 0 59 - - - - - - 7-methylcyanopindolol
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 5DHG 5DHG_refined 3.0 A Inactive 4 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
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
ADRB2 β2 Adrenoceptors A Human X-ray 5D5A 5D5A_refined 2.5 A Inactive 0 68 - - - - T4-Lysozyme - Carazolol
small-molecule Inverse agonist (-)-noradrenaline, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, 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
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
ACM1 M1 Acetylcholine (muscarinic) A Human X-ray 5CXV 5CXV_refined 2.7 A Inactive 2 62 - - - - T4-Lysozyme - 0HK
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 2016-03-09 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
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 5IU8 5IU8_refined 2.0 A Inactive 1 71 - - - - BRIL - CHEMBL3934661
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 5IUB 5IUB_refined 2.1 A Inactive 1 71 - - - - BRIL - CHEMBL184061
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 5L7D 5L7D_refined 3.2 B Inactive 4 59 - - - - BRIL - - - - - - 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
AA2AR A2A Adenosine A Human X-ray 5G53 5G53_refined 3.4 A Active 100 68 Gs αs Engineered G protein 50 - - NECA
small-molecule Agonist adenosine small-molecule Yes No Carpenter B, Nehme R, Warne T, Leslie AG, Tate CG 10.1038/NATURE18966 2016-08-03 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)
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 14 66 - - - - T4-Lysozyme - ENDOTHELIN
protein Agonist endothelin-2, endothelin-3, 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 - - 2016-09-21 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
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
CNR1 CB1 Cannabinoid A Human X-ray 5U09 5U09_refined 2.6 A Inactive 10 60 - - - - Glycogen synthase - taranabant
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
NTR1 NTS1 Neurotensin A Rat X-ray 5T04 5T04_refined 3.3 A Active 87 69 - - - - T4-Lysozyme - neurotensin
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
AA2AR A2A Adenosine A Human X-ray 5UIG 5UIG_refined 3.5 A Inactive 18 70 - - - - BRIL - 5-Amino-N-[(2-Methoxyphenyl)methyl]-2-(3-Methylphenyl)-2h-1,2,3-Triazole-4-Carboximidamide
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
OPSD Rhodopsin Opsins A Bovine X-ray 5TE3 5TE3_refined 2.7 A Active 98 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
AGTR2 AT2 Angiotensin A Human X-ray 5UNF 5UNF_refined 2.8 A Active 99 79 - - - - 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 5NDD 5NDD_refined 2.8 A Intermediate 41 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
PAR2 PAR2 Proteinase-activated A Human X-ray 5NDZ 5NDZ_refined 3.6 A Intermediate 41 74 - - - - BRIL - AZ3451
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
CALCR CT Calcitonin B1 Human Cryo-EM 5UZ7 5UZ7_refined 4.1 R Active 100 56 Gs αs - 47 - - - - - calcitonin, calcitonin (salmon), adrenomedullin 2/intermedin, α-CGRP, β-CGRP, amylin, adrenomedullin 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
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
G1SGD4 GLP-1 Glucagon B1 Rabbit Cryo-EM 5VAI - 4.1 R Active 100 84 Gs αs - 59 - - CHEMBL410972
protein Agonist - - No No Zhang Y, Sun B, Feng D, Hu H, Chu M, Qu Q, Tarrasch JT, Li S, Sun Kobilka T, Kobilka BK, Skiniotis G 10.1038/NATURE22394 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
APJ apelin Apelin A Human X-ray 5VBL - 2.6 B Inactive 4 79 - - - - Rubredoxin - AMG3054
peptide Agonist [Pyr1]apelin-13, apelin-17, apelin receptor early endogenous ligand, Elabela/Toddler-11, Elabela/Toddler-21, apelin-13, Elabela/Toddler-32, apelin-36 peptide Yes No Ma Y, Yue Y, Ma Y, Zhang Q, Zhou Q, Song Y, Shen Y, Li X, Ma X, Li C, Hanson MA, Han GW, Sickmier EA, Swaminath G, Zhao S, Stevens RC, Hu LA, Zhong W, Zhang M, Xu F 10.1016/J.STR.2017.04.008 2017-05-31 Yes
FFAR1 FFA1 Free fatty acid A Human X-ray 5TZY 5TZY_refined 3.2 A Intermediate 41 91 - - - - T4-Lysozyme - MK-8666
(2S,3R)-3-Cyclopropyl-3-[(2R)-2-[1-[(1S)-1-[5-fluoro-2-(trifluoromethoxy)phenyl]ethyl]piperidin-4-yl]-3,4-dihydro-2H-chromen-7-yl]-2-methylpropanoic acid
small-molecule
small-molecule		 Agonist
PAM		 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 94 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
CNR1 CB1 Cannabinoid A Human X-ray 5XRA 5XRA_refined 2.8 A Active 94 60 - - - - Flavodoxin - AM11542
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 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
AA2AR A2A Adenosine A Human X-ray 5N2R 5N2R_refined 2.8 A Inactive 1 71 - - - - BRIL - PSB36
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 88 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
ADRB2 β2 Adrenoceptors A Human X-ray 5X7D 5X7D_refined 2.7 A Inactive 0 68 - - - - T4-Lysozyme - 4-carbamoyl-N-[(2R)-2-cyclohexyl-2-phenylacetyl]-L-phenylalanyl-3-bromo-N-methyl-L-phenylalaninamide
Carazolol
small-molecule
small-molecule		 Allosteric antagonist
Antagonist		 (-)-noradrenaline, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ small-molecule Yes No Liu X, Ahn S, Kahsai AW, Meng KC, Latorraca NR, Pani B, Venkatakrishnan AJ, Masoudi A, Weis WI, Dror RO, Chen X, Lefkowitz RJ, Kobilka BK 10.1038/NATURE23652 2017-08-16 Yes
EDNRB ETB Endothelin A Human X-ray 5X93 5X93_refined 2.2 A Inactive 4 71 - - - - T4-Lysozyme - K-8794
small-molecule Antagonist endothelin-2, endothelin-3, 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
Q08BG4 LPA6 Lysophospholipid (LPA) A Zebrafish X-ray 5XSZ 5XSZ_refined 3.2 A Active 67 78 - - - - T4-Lysozyme - Apo (no ligand)
none Apo (no ligand) - - Yes No Taniguchi R, Inoue A, Sayama M, Uwamizu A, Yamashita K, Hirata K, Yoshida M, Tanaka Y, Kato HE, Nakada-Nakura Y, Otani Y, Nishizawa T, Doi T, Ohwada T, Ishitani R, Aoki J, Nureki O 10.1038/NATURE23448 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
DRD4 D4 Dopamine A Human X-ray 5WIU - 2.0 A Inactive 1 64 - - - - BRIL - [3H]NEMONAPRIDE
small-molecule Antagonist dopamine small-molecule Yes No 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
OPSD Rhodopsin Opsins A Bovine X-ray 2I37 2I37_refined 4.2 A Inactive 21 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 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 2PED - 3.0 B Inactive 21 100 - - - - - - Retinal (9-cis)
small-molecule Inverse agonist - - No No Nakamichi H, Buss V, Okada T 10.1529/BIOPHYSJ.107.108225 2007-10-30 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 2R4R 2R4R_refined 3.4 A Inactive 1 52 - - - - - Antibody - - - (-)-noradrenaline, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, 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 Yes
OPSD Rhodopsin Opsins A Japanese flying squid X-ray 2ZIY - 3.7 A Inactive 16 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 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, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, 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
OPSD Rhodopsin Opsins A Bovine X-ray 3CAP - 2.9 A Active 98 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 Yes
OPSD Rhodopsin Opsins A Bovine X-ray 3C9L 3C9L_refined 2.7 A Inactive 21 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
ADRB2 β2 Adrenoceptors A Human X-ray 3KJ6 - 3.4 A Inactive 1 54 - - - - - Antibody - - - (-)-noradrenaline, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, 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 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, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, 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 4 83 - - - - T4-Lysozyme - isothiourea-1t
small-molecule Antagonist CXCL12γ, CXCL12, CXCL12α, CXCL12δ, CXCL12ε, CXCL12φ, CXCL12β 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 3OE6_refined 3.2 A Inactive 4 77 - - - - T4-Lysozyme - isothiourea-1t
small-molecule Antagonist CXCL12γ, CXCL12, CXCL12α, CXCL12δ, CXCL12ε, CXCL12φ, CXCL12β 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 3OE9 3OE9_refined 3.1 A Inactive 4 74 - - - - T4-Lysozyme - isothiourea-1t
small-molecule Antagonist CXCL12γ, CXCL12, CXCL12α, CXCL12δ, CXCL12ε, CXCL12φ, CXCL12β 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
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 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
ADRB2 β2 Adrenoceptors A Human X-ray 3PDS 3PDS_refined 3.5 A Inactive 0 68 - - - - T4-Lysozyme - FAUC50
small-molecule Agonist (-)-noradrenaline, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, 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
ADRB2 β2 Adrenoceptors A Human X-ray 3P0G 3P0G_refined 3.5 A Active 99 69 - - - - T4-Lysozyme Nanobody CHEMBL1615159
small-molecule Agonist (-)-noradrenaline, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, 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
OPSD Rhodopsin Opsins A Bovine X-ray 3PXO - 3.0 A Active 98 94 - - - - - - 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 2YDO 2YDO_refined 3.0 A Active 67 73 - - - - - - adenosine
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 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
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 2YCZ 2YCZ_refined 3.7 B Inactive 0 60 - - - - - - Iodocyanopindolol
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 2 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
OPSD Rhodopsin Opsins A Japanese flying squid X-ray 3AYM - 2.8 B Inactive 16 77 - - - - - - Retinal (all-trans)
small-molecule Agonist - - Yes No Murakami M, Kouyama T 10.1016/J.JMB.2011.08.044 2011-08-17 Yes
OPSD Rhodopsin Opsins A Japanese flying squid X-ray 3AYN - 2.7 B Inactive 16 77 - - - - - - Retinal (9-cis)
small-molecule Inverse agonist - - Yes No Murakami M, Kouyama T 10.1016/J.JMB.2011.08.044 2011-08-17 Yes
AA2AR A2A Adenosine A Human X-ray 3REY 3REY_refined 3.3 A Inactive 1 71 - - - - - - xanthine amine congener
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
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
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
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
S1PR1 S1P1 Lysophospholipid (S1P) A Human X-ray 3V2W 3V2W_refined 3.4 A Inactive 1 68 - - - - T4-Lysozyme - W146
small-molecule Antagonist dihydrosphingosine 1-phosphate, sphingosine 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
ACM3 M3 Acetylcholine (muscarinic) A Rat X-ray 4DAJ - 3.4 A Inactive 2 46 - - - - T4-Lysozyme - tiotropium
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 Yes
OPRK κ Opioid A Human X-ray 4DJH 4DJH_refined 2.9 A Inactive 4 76 - - - - T4-Lysozyme - JDTic
small-molecule Antagonist dynorphin A, β-neoendorphin, [Leu]enkephalin, dynorphin B, dynorphin A-(1-8), β-endorphin, α-neoendorphin, [Met]enkephalin, dynorphin A-(1-13), big dynorphin 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
OPRD δ Opioid A Mouse X-ray 4EJ4 4EJ4_refined 3.4 A Inactive 4 76 - - - - T4-Lysozyme - naltrindole
small-molecule Antagonist [Leu]enkephalin, α-neoendorphin, [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
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
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
ADRB2 β2 Adrenoceptors A Human X-ray 4GBR 4GBR_refined 4.0 A Inactive 0 69 - - - - T4-Lysozyme - Carazolol
small-molecule Inverse agonist (-)-noradrenaline, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ small-molecule Yes No Zou Y, Weis WI, Kobilka BK 10.1371/JOURNAL.PONE.0046039 2012-10-24 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
5HT1B 5-HT1B 5-Hydroxytryptamine A Human X-ray 4IAR 4IAR_refined 2.7 A Inactive 14 70 - - - - BRIL - ergotamine
small-molecule Agonist tryptamine, 5-HT-moduline, 5-hydroxytryptamine 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
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 3ZPQ 3ZPQ_refined 2.8 B Inactive 0 62 - - - - - - CHEMBL200234
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 4BEZ 4BEZ_refined 3.3 A Active 98 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 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
CRFR1 CRF1 Corticotropin-releasing factor B1 Human X-ray 4K5Y - 3.0 C Inactive 17 60 - - - - T4-Lysozyme - CP 376,395
small-molecule Antagonist urocortin 2, urocortin 1, corticotrophin-releasing hormone peptide No No Hollenstein K, Kean J, Bortolato A, Cheng RK, Dore AS, Jazayeri A, Cooke RM, Weir M, Marshall FH 10.1038/NATURE12357 2013-07-17 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 4LDE 4LDE_refined 2.8 A Active 99 69 - - - - T4-Lysozyme Nanobody CHEMBL1615159
small-molecule Agonist (-)-noradrenaline, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, 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
ADRB2 β2 Adrenoceptors A Human X-ray 4LDO 4LDO_refined 3.2 A Active 99 69 - - - - T4-Lysozyme Nanobody (-)-adrenaline
small-molecule Agonist (-)-noradrenaline, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, 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
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
ACM2 M2 Acetylcholine (muscarinic) A Human X-ray 4MQT 4MQT_refined 3.7 A Active 99 59 - - - - - Nanobody iperoxo
LY2119620
small-molecule
small-molecule		 Agonist
PAM		 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
OPRD δ Opioid A Human X-ray 4N6H 4N6H_refined 1.8 A Inactive 4 81 - - - - BRIL - naltrindole
small-molecule Antagonist dynorphin A, [Leu]enkephalin, endomorphin-1, dynorphin B, dynorphin A-(1-8), β-endorphin, α-neoendorphin, [Met]enkephalin, dynorphin A-(1-13) 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 3ZEV 3ZEV_refined 3.0 A Inactive 3 72 - - - - - - neurotensin
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 Yes
NTR1 NTS1 Neurotensin A Rat X-ray 4BV0 4BV0_refined 3.1 A Inactive 3 70 - - - - - - neurotensin
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 Yes
SMO SMO Frizzled F Human X-ray 4O9R 4O9R_refined 3.2 A Inactive 11 42 - - - - BRIL - cyclopamine
small-molecule Antagonist - - No No Weierstall U, James D, Wang C, White TA, Wang D, Liu W, Spence JC, Bruce Doak R, Nelson G, Fromme P, Fromme R, Grotjohann I, Kupitz C, Zatsepin NA, Liu H, Basu S, Wacker D, Han GW, Katritch V, Boutet S, Messerschmidt M, Williams GJ, Koglin JE, Marvin Seibert M, Klinker M, Gati C, Shoeman RL, Barty A, Chapman HN, Kirian RA, Beyerlein KR, Stevens RC, Li D, Shah ST, Howe N, Caffrey M, Cherezov V 10.1038/NCOMMS4309 2014-03-05 Yes
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 4PXZ 4PXZ_refined 2.5 A Intermediate 41 84 - - - - BRIL - 2MeSADP
small-molecule Agonist ATP, ADP 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
GRM5 mGlu5 Metabotropic glutamate C Human X-ray 4OO9 4OO9_refined 2.6 A Inactive - 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
SMO SMO Frizzled F Human X-ray 4QIM 4QIM_refined 2.6 A Inactive 7 45 - - - - BRIL - ANTA XV
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 2014-07-23 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 4QKX 4QKX_refined 3.3 A Active 99 69 - - - - T4-Lysozyme Nanobody Q27453560
small-molecule Agonist (-)-noradrenaline, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, 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 4U15 4U15_refined 2.8 B Inactive 2 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
OPRD δ Opioid A Human X-ray 4RWA 4RWA_refined 3.3 A Inactive 4 77 - - - - BRIL - DIPP-NH2
peptide Antagonist dynorphin A, [Leu]enkephalin, endomorphin-1, dynorphin B, dynorphin A-(1-8), β-endorphin, α-neoendorphin, [Met]enkephalin, dynorphin A-(1-13) 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
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
US28 US28 Unclassified A strain AD169 X-ray 4XT1 - 2.9 A Active 100 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
US28 US28 Unclassified A strain AD169 X-ray 4XT3 4XT3_refined 3.8 A Active 100 81 - - - - - - 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 4UG2 4UG2_refined 2.6 A Active 67 71 - - - - - - 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
AGTR1 AT1 Angiotensin A Human X-ray 4YAY 4YAY_refined 2.9 A Inactive 4 79 - - - - BRIL - ZD-7155
small-molecule Antagonist angiotensin II, angiotensin IV, angiotensin A, 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 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
OPSD Rhodopsin Opsins A Japanese flying squid X-ray 4WW3 4WW3_refined 2.8 A Inactive 16 78 - - - - - - Retinal (all-trans)
small-molecule Agonist - - Yes No Murakami M, Kouyama T 10.1371/JOURNAL.PONE.0126970 2015-06-17 Yes
NTR1 NTS1 Neurotensin A Rat X-ray 4XES 4XES_refined 2.6 A Active 87 72 - - - - T4-Lysozyme - neurotensin
peptide Agonist neuromedin N, neurotensin peptide Yes No Krumm BE, White JF, Shah P, Grisshammer R 10.1038/NCOMMS8895 2015-07-29 Yes
OPRM μ Opioid A Mouse X-ray 5C1M 5C1M_refined 2.1 A Active 100 74 - - - - - Antibody BU72
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
GRM5 mGlu5 Metabotropic glutamate C Human X-ray 5CGC 5CGC_refined 3.1 A Inactive - 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
GRM5 mGlu5 Metabotropic glutamate C Human X-ray 5CGD 5CGD_refined 2.6 A Inactive - 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
AGTR1 AT1 Angiotensin A Human X-ray 4ZUD 4ZUD_refined 2.8 A Inactive 4 75 - - - - BRIL - OLMESARTAN
small-molecule Inverse agonist angiotensin II, angiotensin IV, angiotensin A, angiotensin III 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
OPRX NOP Opioid A Human X-ray 5DHH 5DHH_refined 3.0 A Inactive 4 76 - - - - BRIL - SB 612111
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
ADRB1 β1 Adrenoceptors A Wild turkey X-ray 5F8U 5F8U_refined 3.4 A Inactive 0 57 - - - - - - (S)-Cyanopindolol
small-molecule Antagonist - - Yes No Leslie AG, Warne T, Tate CG 10.1038/NSMB.3130 2015-12-23 Yes
ADRB2 β2 Adrenoceptors A Human X-ray 5D5B 5D5B_refined 3.8 A Inactive 0 68 - - - - T4-Lysozyme - Carazolol
small-molecule Inverse agonist (-)-noradrenaline, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, 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
OX1R OX1 Orexin A Human X-ray 4ZJC 4ZJC_refined 2.8 A Inactive 1 72 - - - - GlgA glycogen synthase - SB-674042
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 2 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
GLR glucagon Glucagon B1 Human X-ray 5EE7 5EE7_refined 2.5 A Inactive 0 54 - - - - T4-Lysozyme - Octaethylene glycol monoethyl ether
MK-0893
small-molecule
small-molecule		 Antagonist
NAM		 glucagon peptide No No Jazayeri A, Dore AS, Lamb D, Krishnamurthy H, Southall SM, Baig AH, Bortolato A, Koglin M, Robertson NJ, Errey JC, Andrews SP, Teobald I, Brown AJ, Cooke RM, Weir M, Marshall FH 10.1038/NATURE17414 2016-04-20 Yes
CRFR1 CRF1 Corticotropin-releasing factor B1 Human X-ray 4Z9G - 3.2 A Inactive 17 63 - - - - T4-Lysozyme - CP 376,395
small-molecule Antagonist urocortin 2, urocortin 1, corticotrophin-releasing hormone peptide No No Dore AS, Bortolato A, Hollenstein K, Cheng RKY, Read RJ, Marshall FH 10.2174/1874467210666170110114727 2016-06-29 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
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
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, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, 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
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
OPSD Rhodopsin Opsins A Bovine X-ray 5DYS 5DYS_refined 2.3 A Active 98 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
ADRB2 β2 Adrenoceptors A Human X-ray 5D6L 5D6L_refined 3.2 A Inactive 0 68 - - - - T4-Lysozyme - Carazolol
small-molecule Inverse agonist (-)-noradrenaline, (-)-adrenaline, noradrenaline, L-NOREPINEPHRINE, Zn2+ small-molecule Yes No Ma P, Weichert D, Aleksandrov LA, Jensen TJ, Riordan JR, Liu X, Kobilka BK, Caffrey M 10.1038/NPROT.2017.057 2016-08-17 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-3, 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 5K2A 5K2A_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
AA2AR A2A Adenosine A Human X-ray 5K2C 5K2C_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
CNR1 CB1 Cannabinoid A Human X-ray 5TGZ 5TGZ_refined 2.8 A Inactive 10 61 - - - - Flavodoxin - AM6538
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
CCR2 CCR2 Chemokine A Human X-ray 5T1A 5T1A_refined 2.8 A Inactive 15 76 - - - - T4-Lysozyme - CCR2-RA-[R]
BMS-681
small-molecule
small-molecule		 Allosteric antagonist
Antagonist		 CCL13, CCL11, CCL7, CCL24, CCL8, CCL16, CCL2, CCL26 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
5HT2B 5-HT2B 5-Hydroxytryptamine A Human X-ray 5TVN 5TVN_refined 2.9 A Intermediate 41 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
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
OPSD Rhodopsin Opsins A Bovine X-ray 5TE5 5TE5_refined 4.0 A Inactive 21 100 - - - - - - 10,20-Methanoretinal
small-molecule Agonist - - 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]
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
AGTR2 AT2 Angiotensin A Human X-ray 5UNH 5UNH_refined 2.9 B Active 99 75 - - - - BRIL - compound 2 [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 41 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
GLP1R GLP-1 Glucagon B1 Human X-ray 5VEX 5VEX_refined 3.0 B Inactive 0 57 - - - - T4-Lysozyme - NNC0640
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 2017-05-17 Yes
AA2AR A2A Adenosine A Human X-ray 5UVI 5UVI_refined 3.2 A Inactive 1 72 - - - - BRIL - ZM-241385
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
SMO SMO Frizzled F Human X-ray 5V57 5V57_refined 3.0 A Inactive 1 62 - - - - 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
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 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
AA2AR A2A Adenosine A Human X-ray 5JTB 5JTB_refined 2.8 A Inactive 1 72 - - - - BRIL - ZM-241385
small-molecule Antagonist adenosine small-molecule Yes No Melnikov I, Polovinkin V, Kovalev K, Gushchin I, Shevtsov M, Shevchenko V, Mishin A, Alekseev A, Rodriguez-Valera F, Borshchevskiy V, Cherezov V, Leonard GA, Gordeliy V, Popov A 10.1126/SCIADV.1602952 2017-05-31 Yes
FFAR1 FFA1 Free fatty acid A Human X-ray 5TZR 5TZR_refined 2.2 A Intermediate 41 91 - - - - T4-Lysozyme - MK-8666
small-molecule Allosteric 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
GLP1R GLP-1 Glucagon B1 Human X-ray 5NX2 - 3.7 A Intermediate 30 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
CCR5 CCR5 Chemokine A Human X-ray 5UIW - 2.2 A Inactive 15 85 - - - - Rubredoxin - 5P7-CCL5
protein Antagonist CCL13, CCL11, CCL7, CCL3, CCL8, CCL16, CCL4, CCL2, CCL5, CCL14 peptide No No Zheng Y, Han GW, Abagyan R, Wu B, Stevens RC, Cherezov V, Kufareva I, Handel TM 10.1016/J.IMMUNI.2017.05.002 2017-06-28 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
AA1R A1 Adenosine A Human X-ray 5N2S 5N2S_refined 3.3 A Inactive 1 86 - - - - BRIL - PSB36
small-molecule Agonist adenosine small-molecule Yes No 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
EDNRB ETB Endothelin A Human X-ray 5XPR 5XPR_refined 3.6 A Inactive 4 69 - - - - T4-Lysozyme - bosentan
small-molecule Antagonist endothelin-2, endothelin-3, 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 5NLX - 2.1 A Inactive 1 73 - - - - BRIL - ZM-241385
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
AA2AR A2A Adenosine A Human X-ray 5NM4 - 1.7 A Inactive 1 73 - - - - BRIL - ZM-241385
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
DRD4 D4 Dopamine A Human X-ray 5WIV - 2.1 A Inactive 1 65 - - - - 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
AA2AR A2A Adenosine A Human X-ray 5VRA 5VRA_refined 2.4 A Inactive 1 72 - - - - BRIL - ZM-241385
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
Q9WTK1 BLT1 Leukotriene A Guinea pig X-ray 5X33 5X33_refined 3.7 A Inactive 4 78 - - - - T4-Lysozyme - BIIL 260
small-molecule Antagonist - - Yes