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 |
---|---|---|---|---|---|
4MBZ | Download | Experimental | e4mbzA1 e4mbzB1 e4mbzC1 e4mbzD1 e4mbzE1 e4mbzF1 e4mbzG1 e4mbzH1 e4mbzI1 e4mbzJ1 | jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll | LigPlot |
4MBY | Download | Experimental | e4mbyA1 e4mbyB1 e4mbyB1 e4mbyC1 e4mbyC1 e4mbyD1 e4mbyE1 e4mbyF1 e4mbyG1 e4mbyG1 e4mbyH1 e4mbyH1 e4mbyI1 e4mbyJ1 | jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll | LigPlot |