Ligand name: {[3-(trifluoromethyl)phenyl]methyl}propanedioic acid
PDB ligand accession: LE0
DrugBank: n/a
PubChem: 66519907
ChEMBL: n/a
InChI Key: XSRNMILKEJWHAP-UHFFFAOYSA-N
SMILES: c1cc(cc(c1)C(F)(F)F)CC(C(=O)O)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Phenylpropanoic acids
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein M9SC49

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7U0R	Download	Experimental	e7u0rA1 e7u0rB1	Class II aaRS and biotin synthetases Class II aaRS and biotin synthetases	LigPlot