Structure of PDB 8kar Chain B Binding Site BS01
Receptor Information
>8kar Chain B (length=414) Species:
2287
(Saccharolobus solfataricus) [
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TSNLLVQQVKKLYKVGELLGLDSETIDVLSQPERVMQVKIQIRSSDGKLR
TFIGWRSQHNSALGPYKGGVRYGPNVTQDEVIALSMIMTWKNSLLLLPYG
GGKGGIRVDPKKLTLKELEDLSRKYVQLIHKYLGSDVDIPAPDINTNPQT
MAWFLDEYIKITGKVDFAVFTGKPSELGGIGVRLYSTGLGVATIARDAAN
KFIGGIEGSRVIIQGFGNVGFFTAKFLSEMGAKIIGVSDIGGGVINENGI
DVNRALEVVQSTGSVVNYLEGKKVTNEELLISDCDILIPAAVENVINKFN
APKVRAKLIVEGANGPLTADADEIMKQRGVIVIPDILANAGGVVGSYVEW
ANNRSGGIISDEEAKKLIVDRMINAFNTLYDFHKRKFADQDLRTVAMALA
VDRVVGAMKARGLL
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
8kar Chain B Residue 501 [
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Receptor-Ligand Complex Structure
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PDB
8kar
Structure of glutamate dehydrogenase-AKG
Resolution
1.73 Å
Binding residue
(original residue number in PDB)
K72 G74 M93 K96 K108 A146 N319 G347 S351
Binding residue
(residue number reindexed from 1)
K67 G69 M88 K91 K103 A141 N314 G342 S346
Annotation score
4
External links
PDB
RCSB:8kar
,
PDBe:8kar
,
PDBj:8kar
PDBsum
8kar
PubMed
UniProt
A0A0E3K1C8
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