PDB ligand accession: 0ZP
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: SIGGSNKWBGJQQB-XNTVDALVSA-O
SMILES: CCC(C)CNC(=O)C(CC(C)C)CC(C(CC1CCCCC1)NC(=O)C(Cc2c[nH]c[nH+]2)NC(=O)C(Cc3cccc4c3cccc4)Cc5cccc6c5cccc6)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Naphthalenes
- Subclass: None
- Class: Naphthalenes
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4ER1 | Download | Experimental | e4er1E2 e4er1E3 | cradle loop barrel cradle loop barrel | LigPlot |