PDB ligand accession: 0LG
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: XYJDOUBLYLOJJL-YNYOQIOBSA-N
SMILES: CC(C)c1cccc(c1)CNCC(C2COCC=CCC(NC(=O)c3cc(cc(c3)N(C)S(=O)(=O)C)C(=O)N2)c4ccccc4)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 |
---|---|---|---|---|---|
4DPF | Download | Experimental | e4dpfA2 e4dpfA3 | cradle loop barrel cradle loop barrel | LigPlot |