Structure of PDB 7szg Chain A Binding Site BS01

Receptor Information
>7szg Chain A (length=315) Species: 467598 (Microseira wollei) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TADLILINNWYVVAKVEDCRPGSITTAHLLGVKLVLWRSHEQNSPIQVWQ
DYCPHRGVPLSMGEVANNTLVCPYHGWRYNQAGKCVQIPAHPDMVPPASA
QAKTYHCQERYGLVWVCLGNPVNDIPSFPEWDDPNYHKTYTKSYLIQASP
FRVMDNSIDVSHFPFIHEGILGDRNHAEVEDLEVKVDKDGLTMGKYQVHT
SMVNWFRLSHPLCQYCSTEASEMRTVDLMVVTPIDEDNSVLRYLIMWNGS
KTLESKILADYDQVIEEDIRILHSQQPTRLPLLSGLPQEIHVPSDRCTVA
YRRWLKELGVTYGVC
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 chain7szg Chain A Residue 501 [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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PDB7szg Design principles for site-selective hydroxylation by a Rieske oxygenase.
Resolution2.69 Å
Binding residue
(original residue number in PDB)		C55 H57 R58 C74 Y76 H77 W79
Binding residue
(residue number reindexed from 1)		C53 H55 R56 C72 Y74 H75 W77
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0005506 iron ion binding
GO:0016491 oxidoreductase activity
GO:0046872 metal ion binding
GO:0051537 2 iron, 2 sulfur cluster binding

View graph for
Molecular Function
External links
PDB RCSB:7szg, PDBe:7szg, PDBj:7szg
PDBsum7szg
PubMed35017498
UniProtC3RVP5

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