PDB ligand accession: TRC
DrugBank: DB04562
PubChem:
ChEMBL:
InChI Key: KQTIIICEAUMSDG-UHFFFAOYSA-N
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
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6ACN | Download | Experimental | e6acnA2 e6acnA4 e6acnA5 | The "swivelling" beta/beta/alpha domains Aconitase iron-sulfur domain Aconitase iron-sulfur domain | LigPlot |
5ACN | Download | Experimental | e5acnA2 e5acnA4 e5acnA5 | The "swivelling" beta/beta/alpha domains Aconitase iron-sulfur domain Aconitase iron-sulfur domain | LigPlot |