PDB ligand accession: AR9
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: ZUIGWVKXPZANDI-MJCUULBUSA-N
SMILES: CCCCNC(=O)C(C)CC(C1CC(CCCCCCCC(=O)NC(C(=O)N1)C)C)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Macrolactams
- Subclass: None
- Class: Macrolactams
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3DV1 | Download | Experimental | e3dv1A2 e3dv1A3 e3dv1B2 e3dv1B3 e3dv1C2 e3dv1C3 | cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel | LigPlot |
5QCW | Download | Experimental | e5qcwA1 e5qcwA2 e5qcwB1 e5qcwB2 e5qcwC1 e5qcwC2 | cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel | LigPlot |