Ligand name: 3[N-MORPHOLINO]PROPANE SULFONIC ACID
PDB ligand accession: MPO
DrugBank: DB03434
PubChem: 70807;2723950;
ChEMBL: CHEMBL1234443
InChI Key: DVLFYONBTKHTER-UHFFFAOYSA-N
SMILES: C1COCCN1CCCS(=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 C2JUP1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7YRS	Download	Experimental	e7yrsA1 e7yrsB1 e7yrsE1 e7yrsF1	jelly-roll jelly-roll jelly-roll jelly-roll	LigPlot