Ligand name: oxo(propan-2-ylamino)acetic acid
PDB ligand accession: 40E
DrugBank: n/a
PubChem: 7183008
ChEMBL: CHEMBL4764445
InChI Key: KBMFHCMLHQGQEB-UHFFFAOYSA-N
SMILES: CC(C)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 E0SRA9

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4XDZ	Download	Experimental	e4xdzA1 e4xdzA2 e4xdzB2 e4xdzA1 e4xdzB1 e4xdzB2	6-phosphogluconate dehydrogenase C-terminal domain-like Rossmann-like 6-phosphogluconate dehydrogenase C-terminal domain-like 6-phosphogluconate dehydrogenase C-terminal domain-like Rossmann-like 6-phosphogluconate dehydrogenase C-terminal domain-like	LigPlot
5E4R	Download	Experimental	e5e4rA1 e5e4rA2 e5e4rA3	6-phosphogluconate dehydrogenase C-terminal domain-like Rossmann-like 6-phosphogluconate dehydrogenase C-terminal domain-like	LigPlot