Structure of PDB 6o67 Chain A Binding Site BS02
Receptor Information
>6o67 Chain A (length=257) Species:
9606
(Homo sapiens) [
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ESADLRALAKHLYDSYIKSFPLTKAKARAILTGKTTDKSPFVIYDMNSLM
MGEDKIKKEVAIRIFQGCQFRSVEAVQEITEYAKSIPGFVNLDLNDQVTL
LKYGVHEIIYTMLASLMNKDGVLISEGQGFMTREFLKSLRKPFGDFMEPK
FEFAVKFNALELDDSDLAIFIAVIILSGDRPGLLNVKPIEDIQDNLLQAL
ELQLKLNHPESSQLFAKLLQKMTDLRQIVTEHVQLLQVIKKTETDMSLHP
LLQEIYK
Ligand information
Ligand ID
KNA
InChI
InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H,10,11)
InChIKey
FBUKVWPVBMHYJY-UHFFFAOYSA-N
SMILES
Software
SMILES
ACDLabs 12.01
O=C(O)CCCCCCCC
OpenEye OEToolkits 1.7.2
CCCCCCCCC(=O)O
CACTVS 3.370
CCCCCCCCC(O)=O
Formula
C9 H18 O2
Name
nonanoic acid
ChEMBL
CHEMBL108436
DrugBank
ZINC
ZINC000001529234
PDB chain
6o67 Chain A Residue 502 [
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Receptor-Ligand Complex Structure
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PDB
6o67
Quantitative structural assessment of graded receptor agonism.
Resolution
2.52 Å
Binding residue
(original residue number in PDB)
I262 K263
Binding residue
(residue number reindexed from 1)
I56 K57
Annotation score
1
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0003677
DNA binding
GO:0004879
nuclear receptor activity
Biological Process
GO:0006355
regulation of DNA-templated transcription
Cellular Component
GO:0005634
nucleus
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Molecular Function
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Cellular Component
External links
PDB
RCSB:6o67
,
PDBe:6o67
,
PDBj:6o67
PDBsum
6o67
PubMed
31611383
UniProt
P37231
|PPARG_HUMAN Peroxisome proliferator-activated receptor gamma (Gene Name=PPARG)
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