Ligand name: [(1S)-4-[hydroxy(methyl)amino]-1-(4-methylphenyl)-4-oxobutyl]phosphonic acid
PDB ligand accession: IB3
DrugBank: n/a
PubChem: 86278547
ChEMBL: n/a
InChI Key: YBVPWURHYFIQDS-NSHDSACASA-N
SMILES: Cc1ccc(cc1)C(CCC(=O)N(C)O)P(=O)(O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Toluenes

List of PDB structures and/or AlphaFold models with target protein O96693

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3WQQ	Download	Experimental	e3wqqA2 e3wqqA3 e3wqqB1 e3wqqB2	Rossmann-like FwdE/GAPDH domain-like FwdE/GAPDH domain-like Rossmann-like	LigPlot