Structure of PDB 1qge Chain E Binding Site BS01

Receptor Information
>1qge Chain E (length=97) Species: 337 (Burkholderia glumae) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VVGATDTSTGTLDVANVTDPSTLALLATGAVMINRASGQNDGLVSRCSSL
FGQVISTSYHWNHLDEINQLLGVRGANAEDPVAVIRTHVNRLKLQGV
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 chain1qge Chain E Residue 320 [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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PDB1qge Crystal structure of a bacterial lipase from Chromobacterium viscosum ATCC 6918 refined at 1.6 angstroms resolution.
Resolution1.7 Å
Binding residue
(original residue number in PDB)		D241 D287 Q291 V295
Binding residue
(residue number reindexed from 1)		D19 D65 Q69 V73
Annotation score1
Enzymatic activity
Enzyme Commision number 3.1.1.3: triacylglycerol lipase.
External links
PDB RCSB:1qge, PDBe:1qge, PDBj:1qge
PDBsum1qge
PubMed
UniProtP0DUB9|LIP_PSEPS Triacylglycerol lipase (Gene Name=lip)

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