PDB ligand accession: COI
DrugBank: DB03229
PubChem:
ChEMBL:
InChI Key: BKAJNAXTPSGJCU-UHFFFAOYSA-N
SMILES: CC(C)CC(=O)C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Keto acids and derivatives
- Subclass: Short-chain keto acids and derivatives
- Class: Keto acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1QS0 | Download | Experimental | e1qs0B2 | Thiamin diphosphate-binding fold (THDP-binding) | LigPlot |