PDB ligand accession: MTN
DrugBank: DB08217
PubChem:
ChEMBL: n/a
InChI Key: MXZPGYFBZHBAQM-UHFFFAOYSA-N
SMILES: CC1(C=C(C(N1[O])(C)C)CSS(=O)(=O)C)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyrrolines
- Subclass: None
- Class: Pyrrolines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5BMG | Download | Experimental | e5bmgA1 e5bmgG1 e5bmgH1 e5bmgA1 e5bmgB1 e5bmgH1 e5bmgC1 e5bmgD1 e5bmgE1 e5bmgF1 e5bmgC1 e5bmgD1 e5bmgE1 e5bmgC1 e5bmgD1 e5bmgF1 e5bmgA1 e5bmgB1 e5bmgG1 | beta-Grasp beta-Grasp beta-Grasp beta-Grasp beta-Grasp beta-Grasp beta-Grasp beta-Grasp beta-Grasp beta-Grasp beta-Grasp beta-Grasp beta-Grasp beta-Grasp beta-Grasp beta-Grasp beta-Grasp beta-Grasp beta-Grasp | LigPlot |
5BMH | Download | Experimental | e5bmhA1 | beta-Grasp | LigPlot |
3V3X | Download | Experimental | e3v3xA1 e3v3xC1 e3v3xB1 e3v3xC1 e3v3xD1 | beta-Grasp beta-Grasp beta-Grasp beta-Grasp beta-Grasp | LigPlot |
5BMI | Download | Experimental | e5bmiA1 | beta-Grasp | LigPlot |