PDB ligand accession: DGJ
DrugBank: DB05018
PubChem:
ChEMBL:
InChI Key: LXBIFEVIBLOUGU-DPYQTVNSSA-N
SMILES: C1C(C(C(C(N1)CO)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 |
---|---|---|---|---|---|
3THD | Download | Experimental | e3thdA2 e3thdA3 e3thdB2 e3thdB3 e3thdC7 e3thdC8 e3thdD1 e3thdD2 | jelly-roll TIM beta/alpha-barrel TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll TIM beta/alpha-barrel jelly-roll | LigPlot |