Structure of PDB 2qea Chain C Binding Site BS01

Receptor Information
>2qea Chain C (length=159) Species: 290400 (Jannaschia sp. CCS1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MADLTHEFWDRLEDVRSGMLGIKGQGRLIPMSPQTDDDAPGAIWFITAKG
TDLAKGVAAGPQPAQFVVSDDGEGLYADLDGTLERSTDREALDEFWSFVA
DAWFDGGQHDPDVCLLKFTPASGEISITEGGGARFLYEIAKAHLTDETPD
MGEQATVTF
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 chain2qea Chain C Residue 160 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2qea Crystal structure of putative general stress protein 26 (YP_508897.1) from Jannaschia sp. CCS1 at 2.46 A resolution
Resolution2.46 Å
Binding residue
(original residue number in PDB)		D10 E13 D37
Binding residue
(residue number reindexed from 1)		D10 E13 D37
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:2qea, PDBe:2qea, PDBj:2qea
PDBsum2qea
PubMed
UniProtQ28TU0

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