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 |
---|---|---|---|---|---|
7F9V | Download | Experimental | e7f9vA3 e7f9vB1 | Class II aaRS and biotin synthetases Class II aaRS and biotin synthetases | LigPlot |
7F9P | Download | Experimental | e7f9pA2 | Class II aaRS and biotin synthetases | LigPlot |
7VC5 | Download | Experimental | e7vc5A2 | Class II aaRS and biotin synthetases | LigPlot |
7FAK | Download | Experimental | e7fakA2 | Class II aaRS and biotin synthetases | LigPlot |
7EVU | Download | Experimental | e7evuA2 e7evuB3 | Class II aaRS and biotin synthetases Class II aaRS and biotin synthetases | LigPlot |
7F9T | Download | Experimental | e7f9tA1 e7f9tB1 | Class II aaRS and biotin synthetases Class II aaRS and biotin synthetases | LigPlot |