PDB ligand accession: VPA
DrugBank: n/a
PubChem: 73659098;139033564;
ChEMBL: n/a
InChI Key: SKGTWJNDCFMXKU-GZDQRYBESA-N
SMILES: c1ccc(cc1)CC(=N)NC2C(C(C(C(O2)COC3C(C(C(CO3)O)O)O)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 |
---|---|---|---|---|---|
3WQ5 | Download | Experimental | e3wq5A1 e3wq5B1 | TIM beta/alpha-barrel TIM beta/alpha-barrel | LigPlot |