PDB ligand accession: 1NB
DrugBank: DB06901
PubChem:
ChEMBL: n/a
InChI Key: NEWBFDLFXDTFGD-AEJSXWLSSA-N
SMILES: C=CCC(C=O)C1CCCC1O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Alcohols and polyols
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1BRU | Download | Experimental | e1bruP1 | cradle loop barrel | LigPlot |