Structure of PDB 6vw8 Chain A Binding Site BS01

Receptor Information
>6vw8 Chain A (length=151) Species: 106590 (Cupriavidus necator) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ADATRIAAIVAARQDIPGALLPILHEIQDTQGYIPDAAVPVIARALNLSR
AEVHGVITFYHHFRQQPAGRHVVQVCRAEACQSVGAEALAEHAQRALGCG
FHETTADGQVTLEPVYCLGQCACGPAVMVGEQLHGYVDARRFDALVRSLR
E
Ligand information
Ligand IDFES
InChIInChI=1S/2Fe.2S
InChIKeyNIXDOXVAJZFRNF-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04[Fe]1S[Fe]S1
CACTVS 3.341
OpenEye OEToolkits 1.5.0		S1[Fe]S[Fe]1
FormulaFe2 S2
NameFE2/S2 (INORGANIC) CLUSTER
ChEMBL
DrugBank
ZINC
PDB chain6vw8 Chain A Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6vw8 Crystallographic and kinetic analyses of the FdsBG subcomplex of the cytosolic formate dehydrogenase FdsABG fromCupriavidus necator.
Resolution2.3 Å
Binding residue
(original residue number in PDB)		C86 A90 C91 C127 L128 G129 Q130 C131
Binding residue
(residue number reindexed from 1)		C76 A80 C81 C117 L118 G119 Q120 C121
Annotation score1
Enzymatic activity
Enzyme Commision number 1.2.1.2: Transferred entry: 1.17.1.9.
Gene Ontology
Molecular Function
GO:0003954 NADH dehydrogenase activity
GO:0016491 oxidoreductase activity
GO:0046872 metal ion binding
GO:0051537 2 iron, 2 sulfur cluster binding
Cellular Component
GO:0045271 respiratory chain complex I

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Molecular Function
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Cellular Component
External links
PDB RCSB:6vw8, PDBe:6vw8, PDBj:6vw8
PDBsum6vw8
PubMed32249211
UniProtQ0KDY3

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