Ligand name: 2-oxidanylidene-2-phenylazanyl-ethanoic acid
PDB ligand accession: AOT
DrugBank: n/a
PubChem: 10378
ChEMBL: CHEMBL3248231
InChI Key: PQJZHMCWDKOPQG-UHFFFAOYSA-N
SMILES: c1ccc(cc1)NC(=O)C(=O)O
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 Q3Y316

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5X20	Download	Experimental	e5x20A1 e5x20A2 e5x20B1 e5x20B2 e5x20C1 e5x20C2 e5x20D1 e5x20D2 e5x20E1 e5x20E2	6-phosphogluconate dehydrogenase C-terminal domain-like Rossmann-like 6-phosphogluconate dehydrogenase C-terminal domain-like Rossmann-like Rossmann-like 6-phosphogluconate dehydrogenase C-terminal domain-like 6-phosphogluconate dehydrogenase C-terminal domain-like Rossmann-like Rossmann-like 6-phosphogluconate dehydrogenase C-terminal domain-like	LigPlot