Ligand name: heptyl 1-thio-beta-D-glucopyranoside
PDB ligand accession: HTG
DrugBank: DB04450
PubChem: 656917
ChEMBL: n/a
InChI Key: HPEGNLMTTNTJSP-LBELIVKGSA-N
SMILES: CCCCCCCSC1C(C(C(C(O1)CO)O)O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Carbohydrates and carbohydrate conjugates

List of PDB structures and/or AlphaFold models with target protein D0VWR4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5B66	Download	Experimental	e5b66B1 e5b66D1 e5b66H1 e5b66X1 e5b66d1 e5b66h1 e5b66x1	Photosystem II antenna protein-like Bacterial photosystem II reaction centre L and M subunits-like Photosystem II 10 kDa phosphoprotein PsbH Photosystem II PsbX protein Bacterial photosystem II reaction centre L and M subunits-like Photosystem II 10 kDa phosphoprotein PsbH Photosystem II PsbX protein	LigPlot
5B5E	Download	Experimental	e5b5eD1 e5b5eH1 e5b5eX1 e5b5ed1 e5b5eh1 e5b5ex1	Bacterial photosystem II reaction centre L and M subunits-like Photosystem II 10 kDa phosphoprotein PsbH Photosystem II PsbX protein Bacterial photosystem II reaction centre L and M subunits-like Photosystem II 10 kDa phosphoprotein PsbH Photosystem II PsbX protein	LigPlot
8GN2	Download	Experimental	e8gn2b1 e8gn2d1 e8gn2h1 e8gn2x1	Photosystem II antenna protein-like Bacterial photosystem II reaction centre L and M subunits-like Photosystem II 10 kDa phosphoprotein PsbH Photosystem II PsbX protein	LigPlot