PDB ligand accession: IPA
DrugBank: DB02325
PubChem:
ChEMBL:
InChI Key: KFZMGEQAYNKOFK-UHFFFAOYSA-N
SMILES: CC(C)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Alcohols and polyols
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
| PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
|---|---|---|---|---|---|
| 6D43 | Download | Experimental | e6d43B1 e6d43A1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
| 6UP1 | Download | Experimental | e6up1B1 | TIM beta/alpha-barrel | LigPlot |
| 6UP5 | Download | Experimental | e6up5A1 e6up5B1 e6up5B1 | TIM beta/alpha-barrel TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
| 7SX1 | Download | Experimental | e7sx1A1 e7sx1B1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
| 7T0Q | Download | Experimental | e7t0qA1 e7t0qB1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
| 6UP8 | Download | Experimental | e6up8A1 e6up8B1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
| 7UXV | Download | Experimental | e7uxvA1 e7uxvB1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
| 7UXB | Download | Experimental | e7uxbB1 e7uxbA1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |