PDB ligand accession: RKE
DrugBank: DB19150
PubChem:
ChEMBL:
InChI Key: YQEZLKZALYSWHR-CYBMUJFWSA-N
SMILES: CNC1(CCCCC1=O)c2ccccc2Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Halobenzenes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4F8H | Download | Experimental | e4f8hA1 e4f8hB1 e4f8hB1 e4f8hC1 e4f8hD1 e4f8hC1 e4f8hD1 e4f8hE1 e4f8hA1 e4f8hE1 | Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich | LigPlot |