Structure of PDB 7bkc Chain M Binding Site BS02

Receptor Information
>7bkc Chain M (length=65) Species: 323259 (Methanospirillum hungatei JF-1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EFKVDDEKCTKCGICGNLCEAINVLHKPFSPEIGKVEGEVIWDEAYCDGC
NVCAEACPSEAIKVT
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 chain7bkc Chain M Residue 402 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7bkc Three-megadalton complex of methanogenic electron-bifurcating and CO 2 -fixing enzymes.
Resolution3.0 Å
Binding residue
(original residue number in PDB)
C174 K176 C177 C180 C222 P223 I227
Binding residue
(residue number reindexed from 1)
C9 K11 C12 C15 C57 P58 I62
Annotation score4
Enzymatic activity
Enzyme Commision number 1.2.99.5: Transferred entry: 1.2.7.12.
Gene Ontology
Molecular Function
GO:0016491 oxidoreductase activity

View graph for
Molecular Function
External links
PDB RCSB:7bkc, PDBe:7bkc, PDBj:7bkc
PDBsum7bkc
PubMed34516836
UniProtQ2FKZ4

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