PDB ligand accession: BKL
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: QWPXBEHQFHACTK-PVEDLESJSA-N
SMILES: CC1C2CC(C(C=CC=C(Cc3cc(c(c(c3)OC)Cl)N(C(=O)CC(C4(C1O4)C)O)C)C)OC)(NC(=O)O2)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 |
---|---|---|---|---|---|
7E4Z | Download | Experimental | e7e4zD1 e7e4zD2 | Rossmann-like Bacillus chorismate mutase-like | LigPlot |