Binding Site Information of Target
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T79961 | Target Info | |||
| Target Name | Muscarinic acetylcholine receptor M5 (CHRM5) | ||||
| Synonyms | CHRM5 | ||||
| Target Type | Successful Target | ||||
| Gene Name | CHRM5 | ||||
| Biochemical Class | GPCR rhodopsin | ||||
| UniProt ID | |||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| Ligand Name: Tiotropium | Ligand Info | |||||
| Structure Description | Structure of the M5 muscarinic acetylcholine receptor (M5-T4L) bound to tiotropium | PDB:6OL9 | ||||
| Method | X-ray diffraction | Resolution | 2.54 Å | Mutation | No | [1] |
| PDB Sequence |
RLWEVITIAA
35 VTAVVSLITI45 VGNVLVMISF55 KVNSQLKTVN65 NYYLLSLACA75 DLIIGIFSMN 85 LYTTYILMGR95 WALGSLACDL105 WLALDYVASN115 ARVMNLLVIS125 FDRYFSITRP 135 LTYRAKRTPK145 RAGIMIGLAW155 LISFILWAPA165 ILCWQYLVGK175 RTVPLDECQI 185 QFLSEPTITF195 GTAIAAFYIP205 VSVMTILYCR215 IYRETEKRTN1001 IFEMLRIDEG 1011 LRLKIYKDTE1021 GYYTIGIGHL1031 TKDEAEKLFN1067 QDVDAAVRGI1077 LRNAKLKPVY 1087 DSLDAVRRAA1097 LINMVFQMGE1107 TGVAGFTNSL1117 RMLQQKRWDE1127 AAVNLAKSRW 1137 YNQTPNRAKR1147 VITTFRTGTW1157 DAYRVVLVKE437 RKAAQTLSAI447 LLAFIITWTP 457 YNIMVLVSTF467 CDKCVPVTLW477 HLGYWLCYVN487 STVNPICYAL497 CNRTFRKTFK 507 MLLLCR
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| Ligand Name: Oleic acid | Ligand Info | |||||
| Structure Description | Structure of the M5 muscarinic acetylcholine receptor (M5-T4L) bound to tiotropium | PDB:6OL9 | ||||
| Method | X-ray diffraction | Resolution | 2.54 Å | Mutation | No | [1] |
| PDB Sequence |
RLWEVITIAA
35 VTAVVSLITI45 VGNVLVMISF55 KVNSQLKTVN65 NYYLLSLACA75 DLIIGIFSMN 85 LYTTYILMGR95 WALGSLACDL105 WLALDYVASN115 ARVMNLLVIS125 FDRYFSITRP 135 LTYRAKRTPK145 RAGIMIGLAW155 LISFILWAPA165 ILCWQYLVGK175 RTVPLDECQI 185 QFLSEPTITF195 GTAIAAFYIP205 VSVMTILYCR215 IYRETEKRTN1001 IFEMLRIDEG 1011 LRLKIYKDTE1021 GYYTIGIGHL1031 TKDEAEKLFN1067 QDVDAAVRGI1077 LRNAKLKPVY 1087 DSLDAVRRAA1097 LINMVFQMGE1107 TGVAGFTNSL1117 RMLQQKRWDE1127 AAVNLAKSRW 1137 YNQTPNRAKR1147 VITTFRTGTW1157 DAYRVVLVKE437 RKAAQTLSAI447 LLAFIITWTP 457 YNIMVLVSTF467 CDKCVPVTLW477 HLGYWLCYVN487 STVNPICYAL497 CNRTFRKTFK 507 MLLLCR
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ASN115
3.387
MET119
3.658
LEU161
4.018
TRP162
3.809
PRO164
3.360
ALA165
3.699
CYS168
3.445
TRP169
3.425
LEU172
3.255
PHE187
3.865
THR197
4.675
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| Ligand Name: 3,6,9,12,15,18-Hexaoxaicosane-1,20-diol | Ligand Info | |||||
| Structure Description | Structure of the M5 muscarinic acetylcholine receptor (M5-T4L) bound to tiotropium | PDB:6OL9 | ||||
| Method | X-ray diffraction | Resolution | 2.54 Å | Mutation | No | [1] |
| PDB Sequence |
RLWEVITIAA
35 VTAVVSLITI45 VGNVLVMISF55 KVNSQLKTVN65 NYYLLSLACA75 DLIIGIFSMN 85 LYTTYILMGR95 WALGSLACDL105 WLALDYVASN115 ARVMNLLVIS125 FDRYFSITRP 135 LTYRAKRTPK145 RAGIMIGLAW155 LISFILWAPA165 ILCWQYLVGK175 RTVPLDECQI 185 QFLSEPTITF195 GTAIAAFYIP205 VSVMTILYCR215 IYRETEKRTN1001 IFEMLRIDEG 1011 LRLKIYKDTE1021 GYYTIGIGHL1031 TKDEAEKLFN1067 QDVDAAVRGI1077 LRNAKLKPVY 1087 DSLDAVRRAA1097 LINMVFQMGE1107 TGVAGFTNSL1117 RMLQQKRWDE1127 AAVNLAKSRW 1137 YNQTPNRAKR1147 VITTFRTGTW1157 DAYRVVLVKE437 RKAAQTLSAI447 LLAFIITWTP 457 YNIMVLVSTF467 CDKCVPVTLW477 HLGYWLCYVN487 STVNPICYAL497 CNRTFRKTFK 507 MLLLCR
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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 .P33 or .P332 or .P333 or :3P33;style chemicals stick;color identity;select .A:87 or .A:90 or .A:106 or .A:107 or .A:111 or .A:183 or .A:184 or .A:185 or .A:188 or .A:189 or .A:458 or .A:474 or .A:477 or .A:478 or .A:481; color #00ffc7; zoom selection;set surface opacity 0.5;set surface Van der Waals surface;set mode all
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| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Crystal structure of the M(5) muscarinic acetylcholine receptor. Proc Natl Acad Sci U S A. 2019 Dec 17;116(51):26001-26007. | ||||
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