PDB ligand accession: PC
DrugBank: DB03945
PubChem:
ChEMBL:
InChI Key: YHHSONZFOIEMCP-UHFFFAOYSA-O
SMILES: C[N+](C)(C)CCOP(=O)(O)O
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic nitrogen compounds
- Class: Organonitrogen compounds
- Subclass: Quaternary ammonium salts
- Class: Organonitrogen compounds
- Superclass: Organic nitrogen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7PKD | Download | Experimental | e7pkdJ1 e7pkdF1 e7pkdG1 e7pkdH1 e7pkdI1 e7pkdE1 e7pkdD1 e7pkdC1 e7pkdB1 e7pkdA1 | jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll | LigPlot |
7PKE | Download | Experimental | e7pkeE1 e7pkeD1 e7pkeC1 e7pkeB1 e7pkeA1 | jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll | LigPlot |
1B09 | Download | Experimental | e1b09A1 e1b09B1 e1b09C1 e1b09D1 e1b09E1 | jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll | LigPlot |
7PKH | Download | Experimental | e7pkhJ1 e7pkhF1 e7pkhG1 e7pkhH1 e7pkhI1 e7pkhE1 e7pkhD1 e7pkhC1 e7pkhB1 e7pkhA1 | jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll jelly-roll | LigPlot |