PDB ligand accession: 6GJ
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: FDVLRIHIZWQYRM-XDOBVOAZSA-N
SMILES: CCCCN=C1N2C(CS1)C(C(C(C2O)O)O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Piperidines
- Subclass: None
- Class: Piperidines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3WF1 | Download | Experimental | e3wf1A1 e3wf1A2 e3wf1B1 e3wf1B2 e3wf1C1 e3wf1C2 e3wf1D1 e3wf1D2 | TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll | LigPlot |