Structure of PDB 1s30 Chain A Binding Site BS03

Receptor Information
>1s30 Chain A (length=190) Species: 881 (Nitratidesulfovibrio vulgaris) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KSLKGSRTEKNILTAFAGESQARNRYNYFGGQAKKDGFVQISDIFAETAD
QEREHAKRLFKFLEGGDLEIVAAFPAGIIADTHANLIASAAGEHHEYTEM
YPSFARIAREEGYEEIARVFASIAVAEEFHEKRFLDFARNIKEGRVFLRE
QATKWRCRNCGYVHEGTGAPELCPACAHPKAHFELLGINW
Ligand information
Ligand IDFE
InChIInChI=1S/Fe/q+3
InChIKeyVTLYFUHAOXGGBS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
CACTVS 3.341
OpenEye OEToolkits 1.5.0		[Fe+3]
FormulaFe
NameFE (III) ION
ChEMBL
DrugBankDB13949
ZINC
PDB chain1s30 Chain A Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1s30 Displacement of iron by zinc at the diiron site of Desulfovibrio vulgaris rubrerythrin: X-ray crystal structure and anomalous scattering analysis
Resolution2.05 Å
Binding residue
(original residue number in PDB)		C158 C161 C174 C177
Binding residue
(residue number reindexed from 1)		C157 C160 C173 C176
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
Cellular Component
GO:0005575 cellular_component
GO:0005737 cytoplasm

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Molecular Function
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Cellular Component
External links
PDB RCSB:1s30, PDBe:1s30, PDBj:1s30
PDBsum1s30
PubMed15134924
UniProtP24931|RUBY_NITV2 Rubrerythrin (Gene Name=rbr)

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