Ligand name: N-(1,3-benzodioxol-5-ylmethyl)-2,6-dichlorobenzamide
PDB ligand accession: BXB
DrugBank: n/a
PubChem: 831629
ChEMBL: CHEMBL465952
InChI Key: NMKJFZCBCIUYHI-UHFFFAOYSA-N
SMILES: c1cc(c(c(c1)Cl)C(=O)NCc2ccc3c(c2)OCO3)Cl
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P05091

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3INJ	Download	Experimental	e3injA1 e3injA2 e3injB1 e3injA2 e3injB1 e3injB2 e3injC1 e3injC2 e3injD2 e3injC1 e3injD1 e3injD2 e3injE1 e3injE2 e3injF1 e3injE1 e3injE2 e3injF1 e3injF2 e3injG1 e3injG2 e3injH1 e3injG1 e3injH1 e3injH2	ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like	LigPlot
3INL	Download	Experimental	e3inlA1 e3inlA2 e3inlB1 e3inlA1 e3inlB1 e3inlB2 e3inlC1 e3inlC2 e3inlD2 e3inlC1 e3inlD1 e3inlD2 e3inlE1 e3inlE2 e3inlF1 e3inlE1 e3inlE2 e3inlF1 e3inlF2 e3inlG1 e3inlG2 e3inlH2 e3inlG2 e3inlH1 e3inlH2	ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like ALDH-like	LigPlot