Ligand name: 4-NITROPHENYL 6-THIO-6-S-ALPHA-D-XYLOPYRANOSYL-BETA-D-GLUCOPYRANOSIDE
PDB ligand accession: XTG
DrugBank: DB04807
PubChem: 6102810
ChEMBL: n/a
InChI Key: HQYVHBCTLFPWRQ-ZMFOIVQCSA-N
SMILES: c1cc(ccc1[N+](=O)[O-])OC2C(C(C(C(O2)CSC3C(C(C(CO3)O)O)O)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 P31434

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2F2H	Download	Experimental	e2f2hA2 e2f2hB2 e2f2hD2 e2f2hA4 e2f2hC2 e2f2hB2 e2f2hF2 e2f2hB4 e2f2hC2 e2f2hB2 e2f2hD2 e2f2hC4 e2f2hA2 e2f2hE2 e2f2hD2 e2f2hE4 e2f2hD4 e2f2hE2 e2f2hC2 e2f2hF2 e2f2hE4 e2f2hF3 e2f2hF4	Glycosyl hydrolase domain-like Glycosyl hydrolase domain-like Glycosyl hydrolase domain-like TIM beta/alpha-barrel Glycosyl hydrolase domain-like Glycosyl hydrolase domain-like Glycosyl hydrolase domain-like TIM beta/alpha-barrel Glycosyl hydrolase domain-like Glycosyl hydrolase domain-like Glycosyl hydrolase domain-like TIM beta/alpha-barrel Glycosyl hydrolase domain-like Glycosyl hydrolase domain-like Glycosyl hydrolase domain-like TIM beta/alpha-barrel TIM beta/alpha-barrel Glycosyl hydrolase domain-like Glycosyl hydrolase domain-like Glycosyl hydrolase domain-like TIM beta/alpha-barrel Putative glucosidase YicI, C-terminal domain TIM beta/alpha-barrel	LigPlot