Structure of PDB 8cnz Chain E Binding Site BS01

Receptor Information
>8cnz Chain E (length=251) Species: 39152 (Methanococcus maripaludis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
EKGLLEKYNSLLEFFKNKKVIVAYSGGVDSTLISKIASDNAQTLAVTIDN
GFFSENVIKKAENRAKKYNIPQKTIKIDYLNEITSKDLENRCYNCKKRIA
EELKRIKNELNYDIIVDGTIYDDIFEDRPGIKAFNESNIISPLSNLKFSK
NDVFELSNYLKIDDTCMATRILSAPISKENMAKSNLAEEFIKLNFHIESY
LRVRYLENIAIIELTKNESEKIFDNDSIERINTELKKIGFEKVVLDLNFK
G
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 chain8cnz Chain E Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB8cnz Structure-based insights into the mechanism of [4Fe-4S]-dependent sulfur insertase LarE.
Resolution3.6 Å
Binding residue
(original residue number in PDB)		F56 F57 R95 C96 C99 R132 C174
Binding residue
(residue number reindexed from 1)		F52 F53 R91 C92 C95 R128 C166
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0000166 nucleotide binding
GO:0016783 sulfurtransferase activity
GO:0046872 metal ion binding
GO:0051539 4 iron, 4 sulfur cluster binding

View graph for
Molecular Function
External links
PDB RCSB:8cnz, PDBe:8cnz, PDBj:8cnz
PDBsum8cnz
PubMed38100250
UniProtQ6LXV7

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