Ligand name: [9-[2-carboxy-5-[2-[2-(6-chloranylhexoxy)ethoxy]ethylcarbamoyl]phenyl]-6-(dimethylamino)xanthen-3-ylidene]-dimethyl-azanium
PDB ligand accession: OEH
DrugBank: n/a
PubChem: 58905807
ChEMBL: n/a
InChI Key: YORHEDWUCXZZLS-UHFFFAOYSA-O
SMILES: CN(C)c1ccc2c(c1)OC3=CC(=[N+](C)C)C=CC3=C2c4cc(ccc4C(=O)O)C(=O)NCCOCCOCCCCCCCl
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzopyrans
      • Subclass: 1-benzopyrans

List of PDB structures and/or AlphaFold models with target protein P0A3G3

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6Y7A	Download	Experimental	e6y7aA1	alpha/beta-Hydrolases	LigPlot
7PCW	Download	Experimental	e7pcwA1 e7pcwA1 e7pcwB1 e7pcwC1 e7pcwC1 e7pcwD1	alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot
6ZVY	Download	Experimental	e6zvyA1 e6zvyB1 e6zvyB1	alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot
7PCX	Download	Experimental	e7pcxA1 e7pcxB1 e7pcxF1 e7pcxC1 e7pcxE1 e7pcxD1	alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot
6ZVU	Download	Experimental	e6zvuA1	alpha/beta-Hydrolases	LigPlot
6ZVX	Download	Experimental	e6zvxA1	alpha/beta-Hydrolases	LigPlot
7ZIV	Download	Experimental	e7zivA1	alpha/beta-Hydrolases	LigPlot
6ZVV	Download	Experimental	e6zvvA1 e6zvvB1 e6zvvC1 e6zvvD1	alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot
6ZCC	Download	Experimental	e6zccA1	alpha/beta-Hydrolases	LigPlot
6ZVW	Download	Experimental	e6zvwA1 e6zvwB1 e6zvwB1	alpha/beta-Hydrolases alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot