Ligand name: 4-Hydroxy-Aconitate Ion
PDB ligand accession: ATH
DrugBank: DB03964
InChI Key: WUUVSJBKHXDKBS-ROFOPDMZSA-K
SMILES: C(=C(C(C(=O)[O-])O)C(=O)[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: Tricarboxylic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein Q99798

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name
Q99798	Download	Predicted	Q99798_F1_nD1 Q99798_F1_nD4 Q99798_F1_nD2 Q99798_F1_nD3	Aconitase iron-sulfur domain The "swivelling" beta/beta/alpha domains Aconitase iron-sulfur domain Aconitase iron-sulfur domain