PDB ligand accession: K62
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: GNJDFMNCMAQPGN-QXIHQKPUSA-N
SMILES: CC(C)CN(CC(C(Cc1ccccc1)NC(=O)C2CN(C(=O)O2)c3cccc(c3)C(=O)C)O)S(=O)(=O)c4ccc5c(c4)OCO5
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Carbonyl compounds
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3GI5 | Download | Experimental | e3gi5A1 e3gi5B1 | cradle loop barrel cradle loop barrel | LigPlot |