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 |
---|---|---|---|---|---|
1OZ2 | Download | Experimental | e1oz2A1 | SH3 | LigPlot |
2RJC | Download | Experimental | e2rjcA9 e2rjcA7 e2rjcB8 e2rjcC6 | SH3 SH3 SH3 SH3 | LigPlot |
1OYX | Download | Experimental | e1oyxA3 e1oyxB3 e1oyxC2 | SH3 SH3 SH3 | LigPlot |
1OZ3 | Download | Experimental | e1oz3A3 e1oz3B3 e1oz3C3 | SH3 SH3 SH3 | LigPlot |