Structure of PDB 2fj9 Chain A Binding Site BS01

Receptor Information
>2fj9 Chain A (length=86) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SQAEFEKAAEEVRHLKTKPSDEEMLFIYGHYKQATVGDINTERPGMLDFT
GKAKWDAWNELKGTSKEDAMKAYINKVEELKKKYGI
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain2fj9 Chain A Residue 88 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2fj9 High resolution crystal structures of unliganded and liganded human liver ACBP reveal a new mode of binding for the acyl-CoA ligand.
Resolution1.6 Å
Binding residue
(original residue number in PDB)		E11 H15
Binding residue
(residue number reindexed from 1)		E10 H14
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0000062 fatty-acyl-CoA binding
GO:0008289 lipid binding
GO:0030156 benzodiazepine receptor binding
GO:0036042 long-chain fatty acyl-CoA binding
GO:0042802 identical protein binding
Biological Process
GO:0006631 fatty acid metabolic process
GO:0036151 phosphatidylcholine acyl-chain remodeling
GO:1903060 negative regulation of protein lipidation
GO:1905920 positive regulation of CoA-transferase activity
GO:2001140 positive regulation of phospholipid transport
Cellular Component
GO:0005783 endoplasmic reticulum
GO:0005788 endoplasmic reticulum lumen
GO:0005794 Golgi apparatus
GO:0032994 protein-lipid complex
GO:0070062 extracellular exosome

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:2fj9, PDBe:2fj9, PDBj:2fj9
PDBsum2fj9
PubMed17044054
UniProtP07108|ACBP_HUMAN Acyl-CoA-binding protein (Gene Name=DBI)

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