Target Binding Site Detail
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T22118 | Target Info | |||
| Target Name | Dopamine D1 receptor (D1R) | ||||
| Synonyms | D(1A) dopamine receptor | ||||
| Target Type | Successful Target | ||||
| Gene Name | DRD1 | ||||
| Biochemical Class | GPCR rhodopsin | ||||
| UniProt ID | |||||
| Ligand General Information | Top | ||||
|---|---|---|---|---|---|
| Ligand Name | Cholesterol | Ligand Info | |||
| Canonical SMILES | CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C | ||||
| InChI | 1S/C27H46O/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-20-17-21(28)13-15-26(20,4)25(22)14-16-27(23,24)5/h9,18-19,21-25,28H,6-8,10-17H2,1-5H3/t19-,21+,22+,23-,24+,25+,26+,27-/m1/s1 | ||||
| InChIKey | HVYWMOMLDIMFJA-DPAQBDIFSA-N | ||||
| PubChem Compound ID | 5997 | ||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| PDB ID: 7CKZ Cryo-EM structure of Dopamine and LY3154207 bound dopamine receptor DRD1-Gs signaling complex | ||||||
| Method | Electron microscopy | Resolution | 3.10 Å | Mutation | Yes | [1] |
| PDB Sequence |
FSVRILTACF
29 LSLLILSTLL39 GNTLVCAAVI49 RFRHLRSKVT59 NFFVISLAVS69 DLLVAVLVMP 79 WKAVAEIAGF89 WPFGSFCNIW99 VAFDIMCSTA109 SILNLCVISV119 DRYWAISSPF 129 RYERKMTPKA139 AFILISVAWT149 LSVLISFIPV159 QLSWHKANCD187 SSLSRTYAIS 197 SSVISFYIPV207 AIMIVTYTRI217 YRIAQKQIRR227 IAALERAAVH237 SFKRETKVLK 272 TLSVIMGVFV282 CCWLPFFILN292 CILPFCFCID309 SNTFDVFVWF319 GWANSSLNPI 329 IYAFNADFRK339 AFSTL
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| PDB ID: 7CKY Cryo-EM structure of PW0464 bound dopamine receptor DRD1-Gs signaling complex | ||||||
| Method | Electron microscopy | Resolution | 3.20 Å | Mutation | Yes | [1] |
| PDB Sequence |
FSVRILTACF
29 LSLLILSTLL39 GNTLVCAAVI49 RFRHLRSKVT59 NFFVISLAVS69 DLLVAVLVMP 79 WKAVAEIAGF89 WPFGSFCNIW99 VAFDIMCSTA109 SILNLCVISV119 DRYWAISSPF 129 RYERKMTPKA139 AFILISVAWT149 LSVLISFIPV159 QLSWHKADNC186 DSSLSRTYAI 196 SSSVISFYIP206 VAIMIVTYTR216 IYRIAQKQIR226 RIAALERAAV236 HSFKRETKVL 271 KTLSVIMGVF281 VCCWLPFFIL291 NCILPFCFCI308 DSNTFDVFVW318 FGWANSSLNP 328 IIYAFNADFR338 KAFSTL
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| PDB ID: 7CKW Cryo-EM structure of Fenoldopam bound dopamine receptor DRD1-Gs signaling complex | ||||||
| Method | Electron microscopy | Resolution | 3.22 Å | Mutation | Yes | [1] |
| PDB Sequence |
FSVRILTACF
29 LSLLILSTLL39 GNTLVCAAVI49 RFRHLRSKVT59 NFFVISLAVS69 DLLVAVLVMP 79 WKAVAEIAGF89 WPFGSFCNIW99 VAFDIMCSTA109 SILNLCVISV119 DRYWAISSPF 129 RYERKMTPKA139 AFILISVAWT149 LSVLISFIPV159 QLSWHKNCDS188 SLSRTYAISS 198 SVISFYIPVA208 IMIVTYTRIY218 RIAQKQIRRI228 AALERAAVHS263 FKRETKVLKT 273 LSVIMGVFVC283 CWLPFFILNC293 ILPFCCIDSN311 TFDVFVWFGW321 ANSSLNPIIY 331 AFNADFRKAF341 STL
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| PDB ID: 7CKX Cryo-EM structure of A77636 bound dopamine receptor DRD1-Gs signaling complex | ||||||
| Method | Electron microscopy | Resolution | 3.54 Å | Mutation | Yes | [1] |
| PDB Sequence |
FSVRILTACF
29 LSLLILSTLL39 GNTLVCAAVI49 RFRHLRSKVT59 NFFVISLAVS69 DLLVAVLVMP 79 WKAVAEIAGF89 WPFGSFCNIW99 VAFDIMCSTA109 SILNLCVISV119 DRYWAISSPF 129 RYERKMTPKA139 AFILISVAWT149 LSVLISFIPV159 QLSWHKNCDS188 SLSRTYAISS 198 SVISFYIPVA208 IMIVTYTRIY218 RIAQKQIRRI228 AALERAAVHS263 FKRETKVLKT 273 LSVIMGVFVC283 CWLPFFILNC293 ILPFCCIDSN311 TFDVFVWFGW321 ANSSLNPIIY 331 AFNADFRKAF341 STL
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .CLR or .CLR2 or .CLR3 or :3CLR;style chemicals stick;color identity;select .R:55 or .R:61 or .R:64 or .R:65 or .R:68 or .R:72 or .R:102 or .R:105 or .R:141 or .R:144 or .R:148; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 7X2F Cryo-EM structure of the dopamine and LY3154207-bound D1 dopamine receptor and mini-Gs complex | ||||||
| Method | Electron microscopy | Resolution | 3.00 Å | Mutation | Yes | [2] |
| PDB Sequence |
SVRILTACFL
30 SLLILSTLLG40 NTLVCAAVIR50 FRHLRSKVTN60 FFVISLAVSD70 LLVAVLVMPW 80 KAVAEIAGFW90 PFGSFCNIWV100 AFDIMCSTAS110 ILNLCVISVD120 RYWAISSPFR 130 YERKMTPKAA140 FILISVAWTL150 SVLISFIPVQ160 LSWHKAKDNC186 DSSLSRTYAI 196 SSSVISFYIP206 VAIMIVTYTR216 IYRIAQKQIR226 RIAALERAAV236 HAKNCFKRET 268 KVLKTLSVIM278 GVFVCCWLPF288 FILNCILPFC298 GFCIDSNTFD314 VFVWFGWANS 324 SLNPIIYAFN334 ADFRKAFSTL344 LG
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .CLR or .CLR2 or .CLR3 or :3CLR;style chemicals stick;color identity;select .F:55 or .F:61 or .F:64 or .F:65 or .F:68 or .F:72 or .F:105 or .F:112 or .F:115 or .F:116 or .F:119 or .F:123 or .F:141 or .F:143 or .F:144 or .F:148 or .F:150 or .F:205 or .F:206 or .F:209; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 7X2C Cryo-EM structure of the fenoldopam-bound D1 dopamine receptor and mini-Gs complex | ||||||
| Method | Electron microscopy | Resolution | 3.20 Å | Mutation | Yes | [2] |
| PDB Sequence |
FSVRILTACF
29 LSLLILSTLL39 GNTLVCAAVI49 RFRHLRSKVT59 NFFVISLAVS69 DLLVAVLVMP 79 WKAVAEIAGF89 WPFGSFCNIW99 VAFDIMCSTA109 SILNLCVISV119 DRYWAISSPF 129 RYERKMTPKA139 AFILISVAWT149 LSVLISFIPV159 QLSWHKANCD187 SSLSRTYAIS 197 SSVISFYIPV207 AIMIVTYTRI217 YRIAQKQIRR227 IAALERAAVH237 AKNCFKRETK 269 VLKTLSVIMG279 VFVCCWLPFF289 ILNCILPFCG299 FCIDSNTFDV315 FVWFGWANSS 325 LNPIIYAFNA335 DFRKAFSTL
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .CLR or .CLR2 or .CLR3 or :3CLR;style chemicals stick;color identity;select .F:55 or .F:61 or .F:64 or .F:65 or .F:68 or .F:72 or .F:105 or .F:141 or .F:144 or .F:148; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| PDB ID: 7X2D Cryo-EM structure of the tavapadon-bound D1 dopamine receptor and mini-Gs complex | ||||||
| Method | Electron microscopy | Resolution | 3.30 Å | Mutation | Yes | [2] |
| PDB Sequence |
FSVRILTACF
29 LSLLILSTLL39 GNTLVCAAVI49 RFRHLRSKVT59 NFFVISLAVS69 DLLVAVLVMP 79 WKAVAEIAGF89 WPFGSFCNIW99 VAFDIMCSTA109 SILNLCVISV119 DRYWAISSPF 129 RYERKMTPKA139 AFILISVAWT149 LSVLISFIPV159 QLSWHKAKDN185 CDSSLSRTYA 195 ISSSVISFYI205 PVAIMIVTYT215 RIYRIAQKQI225 RRIAALERAA235 VHAFKRETKV 270 LKTLSVIMGV280 FVCCWLPFFI290 LNCILPFCGF306 CIDSNTFDVF316 VWFGWANSSL 326 NPIIYAFNAD336 FRKAFSTLLG346
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .CLR or .CLR2 or .CLR3 or :3CLR;style chemicals stick;color identity;select .F:55 or .F:61 or .F:64 or .F:65 or .F:68 or .F:72 or .F:105 or .F:141 or .F:144 or .F:148; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
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| PDB ID: 7JVP Cryo-EM structure of SKF-83959-bound dopamine receptor 1 in complex with Gs protein | ||||||
| Method | Electron microscopy | Resolution | 2.90 Å | Mutation | No | [3] |
| PDB Sequence |
FSVRILTACF
29 LSLLILSTLL39 GNTLVCAAVI49 RFRHLRSKVT59 NFFVISLAVS69 DLLVAVLVMP 79 WKAVAEIAGF89 WPFGSFCNIW99 VAFDIMCSTA109 SILNLCVISV119 DRYWAISSPF 129 RYERKMTPKA139 AFILISVAWT149 LSVLISFIPV159 QLSWHKAKPN185 CDSSLSRTYA 195 ISSSVISFYI205 PVAIMIVTYT215 RIYRIAQKQI225 RRIAALERAA235 VHAKFKRETK 269 VLKTLSVIMG279 VFVCCWLPFF289 ILNCILPFCG299 CIDSNTFDVF316 VWFGWANSSL 326 NPIIYAFNAD336 FRKAFSTLLG346
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .CLR or .CLR2 or .CLR3 or :3CLR;style chemicals stick;color identity;select .R:55 or .R:61 or .R:64 or .R:65 or .R:68 or .R:72 or .R:76 or .R:94 or .R:95 or .R:98 or .R:102 or .R:105 or .R:141 or .R:144 or .R:148 or .R:152 or .R:156 or .R:160 or .R:196 or .R:200 or .R:204 or .R:208 or .R:268 or .R:271 or .R:272 or .R:275 or .R:276 or .R:279 or .R:280 or .R:282 or .R:283 or .R:284 or .R:286 or .R:287 or .R:290 or .R:293 or .R:294 or .R:297 or .R:308 or .R:309 or .R:312 or .R:316 or .R:326; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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ARG55
3.354
PHE61
3.530
ILE64
3.653
SER65
4.272
VAL68
3.701
LEU72
3.777
LEU76
3.740
SER94
3.943
PHE95
3.652
ILE98
3.630
PHE102
4.285
MET105
4.561
PHE141
3.614
ILE144
3.948
TRP148
3.633
VAL152
3.757
PHE156
3.569
GLN160
3.338
ILE196
4.373
VAL200
3.951
TYR204
3.666
ALA208
4.755
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| PDB ID: 7JV5 Cryo-EM structure of SKF-81297-bound dopamine receptor 1 in complex with Gs protein | ||||||
| Method | Electron microscopy | Resolution | 3.00 Å | Mutation | No | [3] |
| PDB Sequence |
SVRILTACFL
30 SLLILSTLLG40 NTLVCAAVIR50 FRHLRSKVTN60 FFVISLAVSD70 LLVAVLVMPW 80 KAVAEIAGFW90 PFGSFCNIWV100 AFDIMCSTAS110 ILNLCVISVD120 RYWAISSPFR 130 YERKMTPKAA140 FILISVAWTL150 SVLISFIPVQ160 LSWHKAKPNC186 DSSLSRTYAI 196 SSSVISFYIP206 VAIMIVTYTR216 IYRIAQKQIR226 RIAALERAAV236 HAKNSFKRET 268 KVLKTLSVIM278 GVFVCCWLPF288 FILNCILPFC298 CIDSNTFDVF316 VWFGWANSSL 326 NPIIYAFNAD336 FRKAFSTLLG346 CY
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .CLR or .CLR2 or .CLR3 or :3CLR;style chemicals stick;color identity;select .R:22 or .R:25 or .R:29 or .R:102 or .R:105 or .R:138 or .R:141 or .R:142 or .R:145 or .R:146 or .R:149 or .R:152 or .R:153 or .R:156 or .R:160 or .R:161 or .R:163 or .R:192 or .R:193 or .R:196 or .R:197 or .R:201 or .R:264 or .R:268 or .R:271 or .R:272 or .R:275 or .R:276 or .R:279 or .R:280 or .R:283; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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VAL22
3.968
LEU25
3.692
PHE29
4.959
PHE102
4.381
MET105
4.860
LYS138
4.000
PHE141
3.938
ILE142
3.692
SER145
3.877
VAL146
3.695
THR149
4.263
VAL152
4.904
LEU153
4.241
PHE156
3.601
GLN160
3.668
LEU161
3.921
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| PDB ID: 7JVQ Cryo-EM structure of apomorphine-bound dopamine receptor 1 in complex with Gs protein | ||||||
| Method | Electron microscopy | Resolution | 3.00 Å | Mutation | No | [3] |
| PDB Sequence |
SVRILTACFL
30 SLLILSTLLG40 NTLVCAAVIR50 FRHLRSKVTN60 FFVISLAVSD70 LLVAVLVMPW 80 KAVAEIAGFW90 PFGSFCNIWV100 AFDIMCSTAS110 ILNLCVISVD120 RYWAISSPFR 130 YERKMTPKAA140 FILISVAWTL150 SVLISFIPVQ160 LSWHKAKPID184 NCDSSLSRTY 194 AISSSVISFY204 IPVAIMIVTY214 TRIYRIAQKQ224 IRRIAALERA234 AVHAKNCQFK 265 RETKVLKTLS275 VIMGVFVCCW285 LPFFILNCIL295 PFCFCIDSNT312 FDVFVWFGWA 322 NSSLNPIIYA332 FNADFRKAFS342 TLLGCY
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .CLR or .CLR2 or .CLR3 or :3CLR;style chemicals stick;color identity;select .R:23 or .R:24 or .R:27 or .R:28 or .R:31 or .R:86 or .R:138 or .R:141 or .R:142 or .R:145 or .R:146 or .R:149 or .R:152 or .R:153 or .R:156 or .R:157 or .R:160 or .R:161 or .R:192 or .R:193 or .R:196 or .R:197 or .R:201 or .R:268 or .R:271 or .R:272 or .R:275 or .R:276 or .R:280 or .R:283 or .R:284 or .R:326; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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ARG23
3.515
ILE24
3.727
ALA27
3.902
CYS28
3.699
SER31
3.325
ILE86
4.188
LYS138
4.129
PHE141
3.701
ILE142
3.711
SER145
3.772
VAL146
3.708
THR149
4.375
VAL152
3.712
LEU153
4.997
PHE156
3.355
ILE157
3.829
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| PDB ID: 7LJC Allosteric modulator LY3154207 binding to SKF-81297-bound dopamine receptor 1 in complex with miniGs protein | ||||||
| Method | Electron microscopy | Resolution | 3.00 Å | Mutation | No | [4] |
| PDB Sequence |
SVRILTACFL
30 SLLILSTLLG40 NTLVCAAVIR50 FRHLRSKVTN60 FFVISLAVSD70 LLVAVLVMPW 80 KAVAEIAGFW90 PFGSFCNIWV100 AFDIMCSTAS110 ILNLCVISVD120 RYWAISSPFR 130 YERKMTPKAA140 FILISVAWTL150 SVLISFIPVQ160 LSWHKAKPNC186 DSSLSRTYAI 196 SSSVISFYIP206 VAIMIVTYTR216 IYRIAQKQIR226 RIAALERAAV236 HAKNFKRETK 269 VLKTLSVIMG279 VFVCCWLPFF289 ILNCILPFCC307 IDSNTFDVFV317 WFGWANSSLN 327 PIIYAFNADF337 RKAFSTLLGC347
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .CLR or .CLR2 or .CLR3 or :3CLR;style chemicals stick;color identity;select .R:98 or .R:102 or .R:156 or .R:160 or .R:192 or .R:193 or .R:196 or .R:197 or .R:201 or .R:204 or .R:208 or .R:211 or .R:215 or .R:218 or .R:264 or .R:268 or .R:271 or .R:272 or .R:275 or .R:276 or .R:279 or .R:280 or .R:283 or .R:290 or .R:293 or .R:297; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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ILE98
3.757
PHE102
4.871
PHE156
3.571
GLN160
3.204
ARG192
4.397
THR193
3.571
ILE196
3.767
SER197
4.214
ILE201
3.754
TYR204
3.429
ALA208
3.812
ILE211
3.648
THR215
3.469
|
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| PDB ID: 7LJD Allosteric modulator LY3154207 binding to dopamine-bound dopamine receptor 1 in complex with miniGs protein | ||||||
| Method | Electron microscopy | Resolution | 3.20 Å | Mutation | No | [4] |
| PDB Sequence |
SVRILTACFL
30 SLLILSTLLG40 NTLVCAAVIR50 FRHLRSKVTN60 FFVISLAVSD70 LLVAVLVMPW 80 KAVAEIAGFW90 PFGSFCNIWV100 AFDIMCSTAS110 ILNLCVISVD120 RYWAISSPFR 130 YERKMTPKAA140 FILISVAWTL150 SVLISFIPVQ160 LSWHKAKPID184 NCDSSLSRTY 194 AISSSVISFY204 IPVAIMIVTY214 TRIYRIAQKQ224 IRRIAALERA234 AVHAKNCQFK 265 RETKVLKTLS275 VIMGVFVCCW285 LPFFILNCIL295 PFCCIDSNTF313 DVFVWFGWAN 323 SSLNPIIYAF333 NADFRKAFST343 LLGCY
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Click to Show 3D Structure of This Binding Site
set background white;style ions nothing; color 8e8e8e;style chemicals nothing; select .CLR or .CLR2 or .CLR3 or :3CLR;style chemicals stick;color identity;select .R:23 or .R:24 or .R:27 or .R:28 or .R:31 or .R:35 or .R:138 or .R:141 or .R:142 or .R:145 or .R:146 or .R:149 or .R:150 or .R:152 or .R:153 or .R:156 or .R:157 or .R:160 or .R:161 or .R:192 or .R:193 or .R:196 or .R:197 or .R:200 or .R:201 or .R:205 or .R:268 or .R:271 or .R:272 or .R:275 or .R:276 or .R:279 or .R:280 or .R:283; color #f3c393; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
|
ARG23
3.368
ILE24
3.694
ALA27
4.077
CYS28
4.656
SER31
3.327
LEU35
4.784
LYS138
3.896
PHE141
3.776
ILE142
3.714
SER145
3.728
VAL146
3.848
THR149
4.090
LEU150
4.967
VAL152
3.778
LEU153
5.000
PHE156
4.233
ILE157
4.537
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| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Ligand recognition and allosteric regulation of DRD1-Gs signaling complexes. Cell. 2021 Feb 18;184(4):943-956.e18. | ||||
| REF 2 | Ligand recognition and biased agonism of the D1 dopamine receptor. Nat Commun. 2022 Jun 8;13(1):3186. | ||||
| REF 3 | Structural insights into the human D1 and D2 dopamine receptor signaling complexes. Cell. 2021 Feb 18;184(4):931-942.e18. | ||||
| REF 4 | Mechanism of dopamine binding and allosteric modulation of the human D1 dopamine receptor. Cell Res. 2021 May;31(5):593-596. | ||||
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