Ligand name: VALINE
PDB ligand accession: VAL
DrugBank: DB00161
PubChem: 6287;6971018;88733505;
ChEMBL: CHEMBL43068
InChI Key: KZSNJWFQEVHDMF-BYPYZUCNSA-N
SMILES: CC(C)C(C(=O)O)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of PDB structures and/or AlphaFold models with target protein Q9SKE2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5ECQ	Download	Experimental	e5ecqA2 e5ecqA3 e5ecqD1 e5ecqD3	Rossmann-like domain in Acetyl-CoA synthetase-like proteins Alpha-lytic protease prodomain-like Alpha-lytic protease prodomain-like Rossmann-like domain in Acetyl-CoA synthetase-like proteins	LigPlot
5ECR	Download	Experimental	e5ecrA1 e5ecrA2 e5ecrD1 e5ecrD2	Rossmann-like domain in Acetyl-CoA synthetase-like proteins Alpha-lytic protease prodomain-like Rossmann-like domain in Acetyl-CoA synthetase-like proteins Alpha-lytic protease prodomain-like	LigPlot