Structure of PDB 7cog Chain B Binding Site BS01

Receptor Information
>7cog Chain B (length=320) Species: 95485 (Burkholderia stabilis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ADDYATTRYPIVLVHGLTGTDKYAGVLEYWYGIQEDLQQHGATVYVANLS
GFQSDDGPNGRGEQLLAYVKTVLAATGATKVNLVGHSQGGLTSRYVAAVA
PDLVASVTTIGTPHRGSEFADFVQGVLAYDPTGLSSSVIAAFVNVFGILT
SSSHNTNQDALASLKTLTTAQAATYNQNYPSAGLGAPGSCQTGAPTETVG
GNTHLLYSWAGTAIQPTLSVFGVTGATDTSTIPLVDPANALDPSTLALFG
TGTVMINRGSGQNDGLVSKCSALYGQVLSTSYKWNHIDEINQLLGVRGAF
AEDPVAVIRTHANRLKLAGV
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain7cog Chain B Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB7cog Bacterial triacylglycerol lipase is a potential cholesterol esterase: Identification of a key determinant for sterol-binding specificity.
Resolution2.098 Å
Binding residue
(original residue number in PDB)		D242 D288 Q292 V296
Binding residue
(residue number reindexed from 1)		D242 D288 Q292 V296
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0016787 hydrolase activity
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:7cog, PDBe:7cog, PDBj:7cog
PDBsum7cog
PubMed
UniProtA0A1Y1BQV9

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