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 |
---|---|---|---|---|---|
7B56 | Download | Experimental | e7b56B1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
7B57 | Download | Experimental | e7b57B1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |
7B55 | Download | Experimental | e7b55B1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |