PDB ligand accession: MES
DrugBank: DB03814
PubChem: 78165;4478249;
ChEMBL:
InChI Key: SXGZJKUKBWWHRA-UHFFFAOYSA-N
SMILES: C1COCC[NH+]1CCS(=O)(=O)[O-]
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Oxazinanes
- Subclass: Morpholines
- Class: Oxazinanes
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5L5Q | Download | Experimental | e5l5qY1 | Ntn/PP2C | LigPlot |
5L5P | Download | Experimental | e5l5pJ1 e5l5pK1 e5l5pY1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
5L5I | Download | Experimental | e5l5iY1 | Ntn/PP2C | LigPlot |
5L5D | Download | Experimental | e5l5dY1 | Ntn/PP2C | LigPlot |
5L5J | Download | Experimental | e5l5jY1 | Ntn/PP2C | LigPlot |
5L5O | Download | Experimental | e5l5oY1 | Ntn/PP2C | LigPlot |
5L5H | Download | Experimental | e5l5hY1 | Ntn/PP2C | LigPlot |
5LTT | Download | Experimental | e5lttJ1 e5lttK1 e5lttY1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |