Ligand name: 3-CYCLOHEXYL-1-PROPYLSULFONIC ACID
PDB ligand accession: CXS
DrugBank: DB02219
PubChem: 70815;12546061;
ChEMBL: n/a
InChI Key: PJWWRFATQTVXHA-UHFFFAOYSA-N
SMILES: C1CCC(CC1)NCCCS(=O)(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic nitrogen compounds
    • Class: Organonitrogen compounds
      • Subclass: Cyclohexylamines

List of PDB structures and/or AlphaFold models with target protein G3XD33

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7EMQ	Download	Experimental	e7emqA1 e7emqB1 e7emqB1 e7emqB1 e7emqC1	Heme-binding protein A (HasA) Heme-binding protein A (HasA) Heme-binding protein A (HasA) Heme-binding protein A (HasA) Heme-binding protein A (HasA)	LigPlot
7EMO	Download	Experimental	e7emoA1 e7emoB1 e7emoB1 e7emoC1 e7emoC1	Heme-binding protein A (HasA) Heme-binding protein A (HasA) Heme-binding protein A (HasA) Heme-binding protein A (HasA) Heme-binding protein A (HasA)	LigPlot
7EMR	Download	Experimental	e7emrA1 e7emrB1	Heme-binding protein A (HasA) Heme-binding protein A (HasA)	LigPlot
7EMP	Download	Experimental	e7empA1 e7empA1 e7empB1 e7empC1	Heme-binding protein A (HasA) Heme-binding protein A (HasA) Heme-binding protein A (HasA) Heme-binding protein A (HasA)	LigPlot