PDB ligand accession: IPT
DrugBank: DB01862
PubChem:
ChEMBL:
InChI Key: BPHPUYQFMNQIOC-NXRLNHOXSA-N
SMILES: CC(C)SC1C(C(C(C(O1)CO)O)O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Carbohydrates and carbohydrate conjugates
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7NL2 | Download | Experimental | e7nl2A1 e7nl2B1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |
8BBI | Download | Experimental | e8bbiA1 e8bbiB1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |