Ligand name: ACONITATE ION
PDB ligand accession: TRA
DrugBank: DB04351
PubChem: 5289496
ChEMBL: n/a
InChI Key: GTZCVFVGUGFEME-HNQUOIGGSA-K
SMILES: C(C(=CC(=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 P36683

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1L5J	Download	Experimental	e1l5jA3 e1l5jA6 e1l5jA5 e1l5jB3 e1l5jB4 e1l5jB5	The "swivelling" beta/beta/alpha domains Aconitase iron-sulfur domain Aconitase iron-sulfur domain The "swivelling" beta/beta/alpha domains Aconitase iron-sulfur domain Aconitase iron-sulfur domain	LigPlot