Structure of PDB 7eus Chain A Binding Site BS01

Receptor Information
>7eus Chain A (length=289) Species: 438356 (Cercospora sojina) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
KPYYDVEFNYRLDPRDGGDEVIWGGTVGLMRRKYETRTVRINNERGNEHN
FNLDTHGFAWVKHKTSVTEFADYLAIRQGPYYGEVAEMLKRVTGATKVHV
IGHLHRSLNYNDTTEEEKNAPDMTMTKGQTPGRFVHVDQSYQGAVRRLYL
DLPQEEARRLEKTRWAIINVWRPVRKVTNEPLAVCDARSVREDELFNTLH
LVPMRWPDAAPQENQMWAVAPPKTPTQHKWHYVSGMTEDEALLIKMFDSK
KDGTARRVPHSSFPTPDDFGEPRASTETRCFVFWEDQEA
Ligand information
Ligand IDCU
InChIInChI=1S/Cu/q+2
InChIKeyJPVYNHNXODAKFH-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Cu+2]
CACTVS 3.341[Cu++]
FormulaCu
NameCOPPER (II) ION
ChEMBL
DrugBankDB14552
ZINC
PDB chain7eus Chain A Residue 401 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7eus Molecular Basis of the Unusual Seven-Membered Methylenedioxy Bridge Formation Catalyzed by Fe(II)/alpha-KG-Dependent Oxygenase CTB9
Resolution2.3 Å
Binding residue
(original residue number in PDB)		H170 D172 H294
Binding residue
(residue number reindexed from 1)		H136 D138 H260
Annotation score3
Enzymatic activity
Enzyme Commision number 1.-.-.-
Gene Ontology
Molecular Function
GO:0016491 oxidoreductase activity

View graph for
Molecular Function
External links
PDB RCSB:7eus, PDBe:7eus, PDBj:7eus
PDBsum7eus
PubMed
UniProtA0A2G5I8W0|CTB9_CERBT Hydroxylase/desaturase CTB9 (Gene Name=CTB9)

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