Structure of PDB 2bo2 Chain B Binding Site BS01

Receptor Information
>2bo2 Chain B (length=138) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GCARWCPQDSSCVNATACRCNPGFSSFSEIITTPMETCDDINECATLSSC
GKFSDCWNTEGSYDCVCSPGYEPVSGAKTFKNESENTCQDVDECSSGQHQ
CDSSTVCFNTVGSYSCRCRPGWKPRHGIPNNQKDTVCE
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 chain2bo2 Chain B Residue 155 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB2bo2 Structural and Functional Characterization of a Novel T Cell Receptor Co-Regulatory Protein Complex, Cd97-Cd55.
Resolution2.6 Å
Binding residue
(original residue number in PDB)		D95 V96 E98 N114 T115 S118
Binding residue
(residue number reindexed from 1)		D90 V91 E93 N109 T110 S113
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0004930 G protein-coupled receptor activity
GO:0005509 calcium ion binding
Cellular Component
GO:0016020 membrane

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Molecular Function
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Cellular Component
External links
PDB RCSB:2bo2, PDBe:2bo2, PDBj:2bo2
PDBsum2bo2
PubMed17449467
UniProtQ9UHX3|AGRE2_HUMAN Adhesion G protein-coupled receptor E2 (Gene Name=ADGRE2)

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