Ligand name: 2-(N-MORPHOLINO)-ETHANESULFONIC ACID
PDB ligand accession: MES
DrugBank: DB03814
PubChem: 78165;4478249;
ChEMBL: CHEMBL1234276
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

List of PDB structures and/or AlphaFold models with target protein P0AGG8

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5NJ9	Download	Experimental	e5nj9A1 e5nj9A2 e5nj9C2 e5nj9C3	a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523) a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523) a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523) a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523)	LigPlot
5NJA	Download	Experimental	e5njaA1 e5njaA2 e5njaC2 e5njaC3	a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523) a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523) a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523) a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523)	LigPlot
5NJC	Download	Experimental	e5njcA1 e5njcA2 e5njcC1 e5njcC3	a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523) a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523) a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523) a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523)	LigPlot
5NJB	Download	Experimental	e5njbA1 e5njbA2 e5njbC1 e5njbC2	a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523) a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523) a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523) a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523)	LigPlot
5NJF	Download	Experimental	e5njfA2 e5njfA3 e5njfB1 e5njfB2 e5njfC1 e5njfC3	a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523) a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523) a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523) a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523) a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523) a+b domain in putative modulator of DNA gyrase, PmbA/TldD (Pfam 01523)	LigPlot