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 |
---|---|---|---|---|---|
6UXE | Download | Experimental | e6uxeB1 e6uxeC1 | LYR protein ACP-like | LigPlot |
7RTK | Download | Experimental | e7rtkB1 e7rtkC1 | LYR protein ACP-like | LigPlot |
6W1D | Download | Experimental | e6w1dB1 e6w1dC1 | LYR protein ACP-like | LigPlot |
6WI2 | Download | Experimental | e6wi2B1 e6wi2C1 | LYR protein ACP-like | LigPlot |