Structure of PDB 1h0h Chain B Binding Site BS02

Receptor Information
>1h0h Chain B (length=214) Species: 879 (Megalodesulfovibrio gigas) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SKGFFVDTTRCTACRGCQVACKQWHGNPATPTENTGFHQNPPDFNFHTYK
LVRMHEQEIDGRIDWLFFPDQCRHCIAPPCKATADMEDESAIIHDDATGC
VLFTPKTKDLEDYESVISACPYDVPRKVAESNQMAKCDMCIDRITNGLRP
ACVTSCPTGAMNFGDLSEMEAMASARLAEIKAAYSDAKLCDPDDVRVIFL
TAHNPKLYHEYAVA
Ligand information
Ligand IDSF4
InChIInChI=1S/4Fe.4S
InChIKeyLJBDFODJNLIPKO-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.7[S]12[Fe]3[S]4[Fe]1[S]5[Fe]2[S]3[Fe]45
CACTVS 3.385S1[Fe]S[Fe]1.S2[Fe]S[Fe]2
FormulaFe4 S4
NameIRON/SULFUR CLUSTER
ChEMBL
DrugBank
ZINC
PDB chain1h0h Chain B Residue 1012 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB1h0h Gene Sequence and the 1.8 A Crystal Structure of the Tungsten-Containing Formate Dehydrogenase from Desulfovibrio Gigas
Resolution1.8 Å
Binding residue
(original residue number in PDB)		F4 C21 H25 K50 Q71 C137 D138 M139 C140 C152
Binding residue
(residue number reindexed from 1)		F4 C21 H25 K50 Q71 C137 D138 M139 C140 C152
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding
GO:0051539 4 iron, 4 sulfur cluster binding
Cellular Component
GO:0042597 periplasmic space

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Molecular Function
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Cellular Component
External links
PDB RCSB:1h0h, PDBe:1h0h, PDBj:1h0h
PDBsum1h0h
PubMed12220497
UniProtQ8GC87|FDHB_MEGG1 Formate dehydrogenase subunit beta (Gene Name=fdhB)

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