Structure of PDB 3qvd Chain H Binding Site BS03

Receptor Information
>3qvd Chain H (length=170) Species: 2261 (Pyrococcus furiosus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VVKRTMTKKFLEEAFAGESMAHMRYLIFAEKAEQEGFPNIAKLFRAIAYA
EFVHAKNHFIALGKLGKTPENLQMGIEGETFEVEEMYPVYNKAAEFQGEK
EAVRTTHYALEAEKIHAELYRKAKEKAEKGEDIEIKKVYICPICGYTAVD
EAPEYCPVCGAPKEKFVVFE
Ligand information
Ligand IDFE2
InChIInChI=1S/Fe/q+2
InChIKeyCWYNVVGOOAEACU-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Fe+2]
CACTVS 3.341[Fe++]
FormulaFe
NameFE (II) ION
ChEMBL
DrugBankDB14510
ZINC
PDB chain3qvd Chain H Residue 172 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3qvd A cryo-crystallographic time course for peroxide reduction by rubrerythrin from Pyrococcus furiosus.
Resolution2.0 Å
Binding residue
(original residue number in PDB)		C142 C145 C157 C160
Binding residue
(residue number reindexed from 1)		C141 C144 C156 C159
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005506 iron ion binding
GO:0016491 oxidoreductase activity
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:3qvd, PDBe:3qvd, PDBj:3qvd
PDBsum3qvd
PubMed21647777
UniProtQ9UWP7

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