Ligand name: 2-METHANESULFONYL-BENZENESULFONIC ACID 3-METHYL-5-((1-AMIDINOAMINOOXYMETHYL-CYCLOPROPYL)METHYLOXY)-PHENYLESTER
PDB ligand accession: 81A
DrugBank: n/a
PubChem: 657006
ChEMBL: CHEMBL36040
InChI Key: FXPLUZROHGTSCH-UHFFFAOYSA-N
SMILES: [H]N=C(N)NOCC1(CC1)COc2cc(cc(c2)OS(=O)(=O)c3ccccc3S(=O)(=O)C)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Benzenesulfonic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein P00734

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
1T4U	Download	Experimental	e1t4u.1	cradle loop barrel	LigPlot