PDB ligand accession: AO3
DrugBank: DB04628
PubChem:
ChEMBL:
InChI Key: MDWNFWDBQGOKNZ-XYUDZHFQSA-N
SMILES: CC(=O)NC1C(C(C(OC1OC2C(OC(C(C2O)NC(=O)C)OC3C(C4C(C3O)N=C(O4)N(C)C)CO)CO)CO)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 |
---|---|---|---|---|---|
6HM1 | Download | Experimental | e6hm1A1 e6hm1A2 | FKBP-like TIM beta/alpha-barrel | LigPlot |