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 |
---|---|---|---|---|---|
4B7C | Download | Experimental | e4b7cD3 e4b7cD4 e4b7cF3 e4b7cF4 e4b7cG3 e4b7cG4 e4b7cH3 e4b7cH4 e4b7cI3 e4b7cI4 | GroES-like Rossmann-like GroES-like Rossmann-like GroES-like Rossmann-like GroES-like Rossmann-like GroES-like Rossmann-like | LigPlot |