Structure of PDB 6uo9 Chain A Binding Site BS01

Receptor Information
>6uo9 Chain A (length=675) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
RRAVYIGALFPMSGGWPGGQACQPAVEMALEDVNSRRDILPDYELKLIHH
DSKCDPGQATKYLYELLYNDPIKIILMPGCSSVSTLVAEAARMWNLIVLS
YGSSSPALSNRQRFPTFFRTHPSATLHNPTRVKLFEKWGWKKIATIQQTT
EVFTSTLDDLEERVKEAGIEITFRQSFFSDPAVPVKNLKRQDARIIVGLF
YETEARKVFCEVYKERLFGKKYVWFLIGWYADNWFKIYDPSINCTVDEMT
EAVEGHITTEIVMLNPANTRSISNMTSQEFVEKLTKRLKRHPEETGGFQE
APLAYDAIWALALALNKTSRLEDFNYNNQTITDQIYRAMNSSSFEGVSGH
VVFDASGSRMAWTLIEQLQGGSYKKIGYYDSTKDDLSWSKTDKWIGGSPP
ADQTLVIKTFRFLSQKLFISVSVLSSLGIVLAVVCLSFNIYNSHVRYIQN
SQPNLNNLTAVGCSLALAAVFPLGLDGYHIGRNQFPFVCQARLWLLGLGF
SLGYGSMFTKIWWVHTVFTLEPWKLYATVGLLVGMDVLTLAIWQIVDPLH
RTIETFAKEEPKEDIDVSILPQLEHCSSRKMNTWLGIFYGYKGLLLLLGI
FLAYETKSVSTEKINDHRAVGMAIYNVAVLCLITAPVTMILSSQQDAAFA
FASLAIVFSSYITLVVLFVPKMRRL
Ligand information
Ligand IDQD7
InChIInChI=1S/C4H12NO2P/c1-8(6,7)4-2-3-5/h2-5H2,1H3,(H,6,7)
InChIKeyNHVRIDDXGZPJTJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 12.01C(CCP(C)(O)=O)N
CACTVS 3.385C[P](O)(=O)CCCN
OpenEye OEToolkits 2.0.7CP(=O)(CCCN)O
FormulaC4 H12 N O2 P
Name(R)-(3-aminopropyl)methylphosphinic acid
ChEMBLCHEMBL112710
DrugBank
ZINCZINC000020028798
PDB chain6uo9 Chain A Residue 1001 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6uo9 Structural basis of the activation of a metabotropic GABA receptor.
Resolution4.8 Å
Binding residue
(original residue number in PDB)		W182 S247 G268 S270 W395
Binding residue
(residue number reindexed from 1)		W16 S81 G102 S104 W229
Annotation score1
Binding affinityBindingDB: EC50=200nM
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0004930 G protein-coupled receptor activity
GO:0004965 G protein-coupled GABA receptor activity
Biological Process
GO:0007186 G protein-coupled receptor signaling pathway
Cellular Component
GO:0016020 membrane

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:6uo9, PDBe:6uo9, PDBj:6uo9
PDBsum6uo9
PubMed32555460
UniProtQ9UBS5|GABR1_HUMAN Gamma-aminobutyric acid type B receptor subunit 1 (Gene Name=GABBR1)

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