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 |
---|---|---|---|---|---|
5L5X | Download | Experimental | e5l5xJ1 e5l5xK1 e5l5xX1 e5l5xY1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
5L60 | Download | Experimental | e5l60J1 e5l60K1 e5l60X1 e5l60Y1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
5L61 | Download | Experimental | e5l61J1 e5l61K1 e5l61X1 e5l61Y1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
5L5Y | Download | Experimental | e5l5yJ1 e5l5yK1 e5l5yX1 e5l5yY1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
5L63 | Download | Experimental | e5l63J1 e5l63K1 e5l63X1 e5l63Y1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
5L62 | Download | Experimental | e5l62J1 e5l62K1 e5l62X1 e5l62Y1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |
5L64 | Download | Experimental | e5l64J1 e5l64K1 e5l64X1 e5l64Y1 | Ntn/PP2C Ntn/PP2C Ntn/PP2C Ntn/PP2C | LigPlot |