PDB ligand accession: 147
DrugBank: DB02632
PubChem:
ChEMBL:
InChI Key: IFBHRQDFSNCLOZ-YBXAARCKSA-N
SMILES: c1cc(ccc1[N+](=O)[O-])OC2C(C(C(C(O2)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 |
---|---|---|---|---|---|
1JYW | Download | Experimental | e1jywA1 e1jywA4 e1jywA5 e1jywB1 e1jywB4 e1jywB5 e1jywC1 e1jywC4 e1jywC5 e1jywD1 e1jywD4 e1jywD5 | jelly-roll Glycosyl hydrolase domain-like TIM beta/alpha-barrel jelly-roll Glycosyl hydrolase domain-like TIM beta/alpha-barrel jelly-roll Glycosyl hydrolase domain-like TIM beta/alpha-barrel jelly-roll Glycosyl hydrolase domain-like TIM beta/alpha-barrel | LigPlot |