Structure of PDB 8hyh Chain A Binding Site BS02

Receptor Information
>8hyh Chain A (length=366) Species: 1462 (Geobacillus kaustophilus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MIIGVPKEIKNNENRVAITPAGVLSFVQAGHTVLIEKEAGVGSGFNDSDY
ARAGAQIIERAEDVWAQADMVMKVKEPLPSEYRFFRPGLVLFTYLHLAAD
PELTRVLKESGVIAIAYETVQVGRTLPLLTPMSEVAGRMAAQIGAQFLEK
PYGGKGILLGGVPGVARGKVVIIGGGVVGTNAAKVAVGLGADVTIIDLNA
DRLRELDDIFGNQITTLMSNPMNIAEAVAEADLVIGAVLIPKLVTEDMVK
AMKPGSVIVDVAIDQGGIVETSDHVTTHDNPTYVKHGVVHYAVANMPGAV
PRTSTIALTNVTIPYALQIANKGVMQAITDNPALELGVNVANGEITYEAV
ARDLGYRYVPAREALG
Ligand information
Ligand IDPYR
InChIInChI=1S/C3H4O3/c1-2(4)3(5)6/h1H3,(H,5,6)
InChIKeyLCTONWCANYUPML-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.385CC(=O)C(O)=O
OpenEye OEToolkits 1.7.6CC(=O)C(=O)O
ACDLabs 12.01O=C(C(=O)O)C
FormulaC3 H4 O3
NamePYRUVIC ACID
ChEMBLCHEMBL1162144
DrugBankDB00119
ZINCZINC000001532517
PDB chain8hyh Chain A Residue 1004 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB8hyh Two different alanine dehydrogenases from Geobacillus kaustophilus: Their biochemical characteristics and differential expression in vegetative cells and spores.
Resolution2.39 Å
Binding residue
(original residue number in PDB)		R15 K75 Y94 N300
Binding residue
(residue number reindexed from 1)		R15 K75 Y94 N295
Annotation score5
Enzymatic activity
Enzyme Commision number 1.4.1.1: alanine dehydrogenase.
Gene Ontology
Molecular Function
GO:0000166 nucleotide binding
GO:0000286 alanine dehydrogenase activity
GO:0016491 oxidoreductase activity
Biological Process
GO:0006524 alanine catabolic process
GO:0042853 L-alanine catabolic process
Cellular Component
GO:0005886 plasma membrane

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Molecular Function
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Biological Process
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Cellular Component
External links
PDB RCSB:8hyh, PDBe:8hyh, PDBj:8hyh
PDBsum8hyh
PubMed36918121
UniProtQ5KUA3

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