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 Q5SIY4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4F7I	Download	Experimental	e4f7iA1 e4f7iA2 e4f7iC1 e4f7iC2 e4f7iD1 e4f7iD2	Isocitrate/Isopropylmalate dehydrogenase-like Isocitrate/Isopropylmalate dehydrogenase-like Isocitrate/Isopropylmalate dehydrogenase-like Isocitrate/Isopropylmalate dehydrogenase-like Isocitrate/Isopropylmalate dehydrogenase-like Isocitrate/Isopropylmalate dehydrogenase-like	LigPlot