Structure of PDB 7y5p Chain B Binding Site BS01
Receptor Information
>7y5p Chain B (length=340) Species:
66854
(Saccharothrix mutabilis subsp. capreolus) [
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HHSSGLVPRGSHMTAIREIRLSEPESAQAALLALECAQRYAEPDSADFLA
DAAVLAHDLPRAVRREVERARLDDRLHALVVRGNDVDQDALGPTPPHWRQ
ARTAASRRYGFLLVLYASLLGDVVGWATQQDGRVVTDVLPIEGQEDSLVS
SSSSVELGWHTEDAFSPYRADYVGLFSLRNPDSVATTVAGLDPDLVGPAV
VDVLFGERFHIRPDNSHSDYFAGIVEAVENPRAVSILRGHRDAPQLCVDS
DFTTAVDGDAEAAGALDTLIKHLGGALYEVVLGPGDVAFLDNRNVVHGRR
PFRARFDGTDRWLKRINVTADLRKSRAARRDAQARVLGEA
Ligand information
Ligand ID
AKG
InChI
InChI=1S/C5H6O5/c6-3(5(9)10)1-2-4(7)8/h1-2H2,(H,7,8)(H,9,10)
InChIKey
KPGXRSRHYNQIFN-UHFFFAOYSA-N
SMILES
Software
SMILES
ACDLabs 10.04
O=C(O)C(=O)CCC(=O)O
OpenEye OEToolkits 1.7.6
C(CC(=O)O)C(=O)C(=O)O
CACTVS 3.385
OC(=O)CCC(=O)C(O)=O
Formula
C5 H6 O5
Name
2-OXOGLUTARIC ACID
ChEMBL
CHEMBL1686
DrugBank
DB08845
ZINC
ZINC000001532519
PDB chain
7y5p Chain B Residue 401 [
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Receptor-Ligand Complex Structure
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PDB
7y5p
Crystal structure of the alpha-ketoglutarate-dependent non-heme iron oxygenase CmnC in capreomycin biosynthesis and its engineering to catalyze hydroxylation of the substrate enantiomer.
Resolution
1.7 Å
Binding residue
(original residue number in PDB)
T174 H295 R297 R309 R313
Binding residue
(residue number reindexed from 1)
T186 H297 R299 R311 R315
Annotation score
4
Enzymatic activity
Enzyme Commision number
?
Gene Ontology
Molecular Function
GO:0005506
iron ion binding
GO:0016491
oxidoreductase activity
GO:0046872
metal ion binding
View graph for
Molecular Function
External links
PDB
RCSB:7y5p
,
PDBe:7y5p
,
PDBj:7y5p
PDBsum
7y5p
PubMed
36176888
UniProt
A6YEH4
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