Structure of PDB 7o1r Chain A Binding Site BS01

Receptor Information
>7o1r Chain A (length=227) Species: 1001937 (Hypoxylon sp. EC38) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SGWQAPGPNDVRAPCPMLNTLANHGFLPHDGKGITVNKTIDALGSALNID
ANLSTLLFGFAATTNPQPNATFFDLDHLSRHNILEHDASLSRQDSYFGPA
DVFNEAVFNQTKSFWTGDIIDVQMAANARIVRLLTSNLTNPEYSLSDLGS
AFSIGESAAYIGILGDKKSATVPKSWVEYLFENERLPYELGFKRPNDPFT
TDDLGDLSTQIINAQHFPQSPGKVEKR
Ligand information
Ligand IDMG
InChIInChI=1S/Mg/q+2
InChIKeyJLVVSXFLKOJNIY-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Mg+2]
CACTVS 3.341[Mg++]
FormulaMg
NameMAGNESIUM ION
ChEMBL
DrugBankDB01378
ZINC
PDB chain7o1r Chain A Residue 301 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7o1r Structural and biochemical studies enlighten the unspecific peroxygenase from Hypoxylon sp. EC38 as an efficient oxidative biocatalyst.
Resolution1.3 Å
Binding residue
(original residue number in PDB)		E109 H110 S113
Binding residue
(residue number reindexed from 1)		E85 H86 S89
Annotation score4
Enzymatic activity
Enzyme Commision number 1.11.2.1: unspecific peroxygenase.
Gene Ontology
Molecular Function
GO:0004601 peroxidase activity

View graph for
Molecular Function
External links
PDB RCSB:7o1r, PDBe:7o1r, PDBj:7o1r
PDBsum7o1r
PubMed34540338
UniProtA0A1Y2TH07

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