Structure of PDB 6eur Chain D Binding Site BS02
Receptor Information
>6eur Chain D (length=344) Species:
1144313
(Flavobacterium sp. CF136) [
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TLEIPTSPLIIKITQQERNILSNVGNLLVKAFGNYENPDYIASLHLHAFQ
LLPERITRILSQFGSDFSAEQYGAIVFQGLIEVDQDDLGPTPPNWQGADY
GKLNKYGFICSLLHGAVPSKPVQYYAQRKGGGLLHAVIPDEKMAATQTGS
GSKTDLFVHTEDAFLSNQADFLSFLYLRNEERVPSTLYSIRSHGKMNPVM
KKLFEPIYQCPKDGPTASVLYGNRELPFIRFDAAEQIFNENAGQTSEALG
NLMDFWDEAKTLINSDYIPNSGDLIFVNNHLCAHGRSAFIAGQRIENGEI
IKCERRQMLRMMSKTSLIHIRSVTRTDDPYFIMEEHLGKIFDLD
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
6eur Chain D Residue 402 [
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Receptor-Ligand Complex Structure
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PDB
6eur
Structural Studies based on two Lysine Dioxygenases with Distinct Regioselectivity Brings Insights Into Enzyme Specificity within the Clavaminate Synthase-Like Family.
Resolution
2.3 Å
Binding residue
(original residue number in PDB)
L173 H176 E178 F191 R314 R334 M336 R338
Binding residue
(residue number reindexed from 1)
L156 H159 E161 F174 R286 R306 M308 R310
Annotation score
5
Enzymatic activity
Enzyme Commision number
1.14.11.-
Gene Ontology
Molecular Function
GO:0016706
2-oxoglutarate-dependent dioxygenase activity
GO:0046872
metal ion binding
GO:0051213
dioxygenase activity
View graph for
Molecular Function
External links
PDB
RCSB:6eur
,
PDBe:6eur
,
PDBj:6eur
PDBsum
6eur
PubMed
30410048
UniProt
J3BZS6
|LYS4O_FLASC L-lysine 4-hydroxylase (Gene Name=PMI10_03368)
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