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 |
---|---|---|---|---|---|
5ONY | Download | Experimental | e5onyA1 | Cupredoxin-like | LigPlot |
5ONX | Download | Experimental | e5onxA1 e5onxA2 | Cupredoxin-like Cupredoxin-like | LigPlot |
2XXF | Download | Experimental | e2xxfA2 e2xxfB1 e2xxfB2 | Cupredoxin-like Cupredoxin-like Cupredoxin-like | LigPlot |
1WA0 | Download | Experimental | e1wa0X2 | Cupredoxin-like | LigPlot |
1WA1 | Download | Experimental | e1wa1X2 | Cupredoxin-like | LigPlot |
1WA2 | Download | Experimental | e1wa2X2 | Cupredoxin-like | LigPlot |
2XX0 | Download | Experimental | e2xx0A2 e2xx0A2 e2xx0B2 | Cupredoxin-like Cupredoxin-like Cupredoxin-like | LigPlot |
4CSP | Download | Experimental | e4cspA2 e4cspF2 e4cspF2 | Cupredoxin-like Cupredoxin-like Cupredoxin-like | LigPlot |
2XXG | Download | Experimental | e2xxgA2 e2xxgC2 | Cupredoxin-like Cupredoxin-like | LigPlot |