PDB ligand accession: O8I
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: FOGXVRUMMPWXRL-VURMDHGXSA-N
SMILES: CCC(=O)C(=NO)C(=O)OCC
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Keto acids and derivatives
- Subclass: Beta-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 |
---|---|---|---|---|---|
8AUF | Download | Experimental | e8aufA1 e8aufA1 e8aufB1 | TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
8AU8 | Download | Experimental | e8au8A1 e8au8A1 e8au8B1 | TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |