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 B8YPM3

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7AGD	Download	Experimental	e7agdB2 e7agdD1	cradle loop barrel cradle loop barrel	LigPlot
7AGB	Download	Experimental	e7agbA1 e7agbA2 e7agbD1 e7agbB1 e7agbB2 e7agbC1 e7agbA2 e7agbC1 e7agbB1 e7agbD1	cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel	LigPlot
7AGC	Download	Experimental	e7agcA1 e7agcB1 e7agcB2	cradle loop barrel cradle loop barrel cradle loop barrel	LigPlot