Structures of proteins and ligands binded in their binding sites.
Supplementary material for the article:

Development of iminosugar-based glycosidase inhibitors as drug candidates for SARS-CoV-2 virus via molecular modeling and in vitro studies

Zorana Ferjancic,a Filip Bihelovic,a Bojan Vulovic,a Radomir Matovic,c Milena Trmcic,b Aleksandar Jankovic,c Milos Pavlovic,a Filip Djurkovic,a Radivoje Prodanovic,a Aleksandra Djurdjevic Djelmas,a Nevena Kalicanin,c Mario Zlatovic,a Dusan Sladic,a Thomas Vallet,d Marco Vignuzzi,d,e Radomir N. Saicica,f,*

a University of Belgrade – Faculty of Chemistry, Belgrade, Serbia;
b Innovation Centre of the Faculty of Chemistry, Belgrade, Serbia;
c University of Belgrade - Institute of Chemistry, Technology and Metallurgy, Belgrade;
d Institut Pasteur, Center for the Viral Populations and Pathogenesis, Paris, France;
e A*STAR Infectious Diseases Labs (A*STAR ID Labs), Agency for Science, Technology and Research (A*STAR), 8A Biomedical Grove, Immunos #05-13, Singapore 138648, Singapore;
f Serbian Academy of Sciences and Arts, Belgrade

  1. Structure of α-glucosidase with ligand 1 binded (PDB, 591 kB)
  2. Structure of α-glucosidase with ligand 2 binded (PDB, 591 kB)
  3. Structure of α-glucosidase with ligand 5 binded (PDB, 591 kB)
  4. Structure of α-glucosidase with ligand 6 binded (PDB, 591 kB)
  5. Structure of α-glucosidase with ligand 7 binded (PDB, 591 kB)
  6. Structure of α-glucosidase with ligand 8 binded (PDB, 591 kB)
  7. Structure of α-glucosidase with ligand 9 binded (PDB, 591 kB)
  8. Structure of α-glucosidase with ligand 10 binded (PDB, 591 kB)
  9. Structure of α-glucosidase with ligand 11 binded (PDB, 591 kB)
  10. Structure of α-glucosidase with ligand 12 binded (PDB, 591 kB)
  11. Structure of α-glucosidase with ligand 13 binded (PDB, 591 kB)
  12. Structure of α-glucosidase with ligand 22 binded (PDB, 591 kB)
  13. Structure of α-glucosidase with ligand 38 binded (PDB, 591 kB)
  14. Structure of α-glucosidase with ligand 76 binded (PDB, 591 kB)
  15. Structure of α-glucosidase with ligand 77 binded (PDB, 591 kB)
  16. Structure of α-galactosidase with ligand 4 binded (PDB, 251 kB)
  17. Structure of α-galactosidase with ligand 40 binded (PDB, 251 kB)
  18. Structure of α-galactosidase with ligand 41 binded (PDB, 251 kB)
  19. Structure of α-galactosidase with ligand 42 binded (PDB, 251 kB)
  20. Tabular representation of ligand-protein interactions in the
    binding pocket of α-Glu for compounds 1, 22, 76 and 77 (XLSX, 14 kB)