Ligand name: DIMETHYL SULFOXIDE
PDB ligand accession: DMS
DrugBank: DB01093
PubChem: 679
ChEMBL: CHEMBL504
InChI Key: IAZDPXIOMUYVGZ-UHFFFAOYSA-N
SMILES: CS(=O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organosulfur compounds
    • Class: Sulfoxides
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P59641

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2Z9J	Download	Experimental	e2z9jA1 e2z9jB1 e2z9jA1 e2z9jB1 e2z9jB2	cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain	LigPlot
2Z9L	Download	Experimental	e2z9lB1 e2z9lA1 e2z9lA2 e2z9lB1 e2z9lB2 e2z9lA1	cradle loop barrel cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain cradle loop barrel	LigPlot
2Z9K	Download	Experimental	e2z9kA1 e2z9kA2 e2z9kB1 e2z9kA1 e2z9kB1 e2z9kB2	cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain cradle loop barrel cradle loop barrel cradle loop barrel Coronavirus main proteinase (3Cl-pro, putative coronavirus nsp2) C-terminal domain	LigPlot