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 |
---|---|---|---|---|---|
5TNZ | Download | Experimental | e5tnzA1 | cradle loop barrel | LigPlot |
5M3N | Download | Experimental | e5m3nA1 | cradle loop barrel | LigPlot |
5FHT | Download | Experimental | e5fhtA2 | cradle loop barrel | LigPlot |
5M3O | Download | Experimental | e5m3oA2 | cradle loop barrel | LigPlot |
5WYN | Download | Experimental | e5wynA2 | cradle loop barrel | LigPlot |
5TO0 | Download | Experimental | e5to0A2 | cradle loop barrel | LigPlot |
5TO1 | Download | Experimental | e5to1A1 | cradle loop barrel | LigPlot |
5TNY | Download | Experimental | e5tnyA1 | cradle loop barrel | LigPlot |