Structure of PDB 3bcq Chain B Binding Site BS02

Receptor Information
>3bcq Chain B (length=146) Species: 126311 (Brycon cephalus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VEWSTAERSAIAGLWGKISVDEIGPQALSRLLIVYPWTQRHFAAFGNLSS
PAAINGNPKVAHHGKVVMGGLERAIKNMDNIKAAYSSLSVMHSEKLHVDP
DNFRLLADCITVCVAMKFGPSAFTPDVQEAWQKFLAVVVAALSRYH
Ligand information
Ligand IDOXY
InChIInChI=1S/O2/c1-2
InChIKeyMYMOFIZGZYHOMD-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341
OpenEye OEToolkits 1.5.0		O=O
FormulaO2
NameOXYGEN MOLECULE
ChEMBLCHEMBL1234886
DrugBankDB09140
ZINC
PDB chain3bcq Chain B Residue 148 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3bcq Crystal structure of oxy-hemoglobin from Brycon cephalus
Resolution2.4 Å
Binding residue
(original residue number in PDB)		H63 V67
Binding residue
(residue number reindexed from 1)		H63 V67
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0004601 peroxidase activity
GO:0005344 oxygen carrier activity
GO:0019825 oxygen binding
GO:0020037 heme binding
GO:0031720 haptoglobin binding
GO:0043177 organic acid binding
GO:0046872 metal ion binding
Biological Process
GO:0015671 oxygen transport
GO:0042744 hydrogen peroxide catabolic process
GO:0098869 cellular oxidant detoxification
Cellular Component
GO:0005833 hemoglobin complex
GO:0031838 haptoglobin-hemoglobin complex
GO:0072562 blood microparticle

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:3bcq, PDBe:3bcq, PDBj:3bcq
PDBsum3bcq
PubMed
UniProtD0VWS2

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