Structure of PDB 7zmg Chain I Binding Site BS01

Receptor Information
>7zmg Chain I (length=185) Species: 759272 (Thermochaetoides thermophila DSM 1495) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ATPAGPPPKNFRLPPPKNWDEESESTIDKVGKYFLMTEMLRGMYVLLEQF
FRPPYTIYYPFEKGPISPRFRGEHALRRYPSGEERCIACKLCEAVCPAQA
ITIEAEERADGSRRTTRYDIDMTKCIYCGFCQESCPVDAIVESPNAEYAT
ETREELLYNKEKLLANGDKWEPELAAAIRADAPYR
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 chain7zmg Chain I Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7zmg Conformational changes in mitochondrial complex I of the thermophilic eukaryote Chaetomium thermophilum.
Resolution2.44 Å
Binding residue
(original residue number in PDB)		C124 I125 A126 C127 K128 C130 Y156 C173 A177 I178
Binding residue
(residue number reindexed from 1)		C86 I87 A88 C89 K90 C92 Y118 C135 A139 I140
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0016651 oxidoreductase activity, acting on NAD(P)H
GO:0051539 4 iron, 4 sulfur cluster binding
Cellular Component
GO:0016020 membrane

View graph for
Molecular Function
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Cellular Component
External links
PDB RCSB:7zmg, PDBe:7zmg, PDBj:7zmg
PDBsum7zmg
PubMed36427319
UniProtG0SBG8

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