Structure of PDB 3tf1 Chain A Binding Site BS02

Receptor Information
>3tf1 Chain A (length=188) Species: 119072 (Caldanaerobacter subterraneus subsp. tengcongensis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MKGTIVGTWIKTLRDLYGNDVVDESLKSVGWEPDRVITPLEDIDDDEVRR
IFAKVSEKTGKNVNEIWREVGRQNIKTFSEWFPSYFAGRRLVNFLMMMDE
VHLQLTKMIKGATPPRLIAKPVAKDAIEMEYVSKRKMYDYFLGLIEGSSK
FFKEEISVEEVERGEKDGFSRLKVRIKFKNPVFEYKKN
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 chain3tf1 Chain A Residue 501 [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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PDB3tf1 Tunnels modulate ligand flux in a heme nitric oxide/oxygen binding (H-NOX) domain.
Resolution2.0369 Å
Binding residue
(original residue number in PDB)		F78 Y140
Binding residue
(residue number reindexed from 1)		F78 Y140
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology

View graph for
Molecular Function
External links
PDB RCSB:3tf1, PDBe:3tf1, PDBj:3tf1
PDBsum3tf1
PubMed21997213
UniProtQ8RBX6

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