Structure of PDB 3nvr Chain A Binding Site BS02

Receptor Information
>3nvr Chain A (length=180) Species: 119072 (Caldanaerobacter subterraneus subsp. tengcongensis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MKGTLVGTWIKTLRDLYGNDVVDESLKSVGWEPDRVITPLEDIDDDEVRR
IFAKVSEKTGKNVNEIWREVGRQNIKTFSEWFPSYFAGRRLVNFLMMMDE
VHLQLTKMIKGATPPRLIAKPVAKDAIEMEYVSKRKMYDYFLGLIEGSSK
FFKEEISVEEVERGEKDGFSRLKVRIKFKN
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 chain3nvr Chain A Residue 493 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3nvr Modulating heme redox potential through protein-induced porphyrin distortion
Resolution2.148 Å
Binding residue
(original residue number in PDB)
L5 F78 Y140
Binding residue
(residue number reindexed from 1)
L5 F78 Y140
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology

View graph for
Molecular Function
External links
PDB RCSB:3nvr, PDBe:3nvr, PDBj:3nvr
PDBsum3nvr
PubMed20735135
UniProtQ8RBX6

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