Figure 2 | Scientific Reports

Figure 2

From: Drug design and repurposing with DockThor-VS web server focusing on SARS-CoV-2 therapeutic targets and their non-synonym variants

Figure 2

Conformations of the Mpro provided at the DockThor-VS web server as representative structures of the protein flexibility. The protein complexed structure with a covalent inhibitor is coloured blue (PDB code 6LU7, the ligand is not shown) and the structure initially complexed with a non-covalent inhibitor is coloured green (PDB code 6W63). The protein–ligand hydrogen bonds are represented as yellow dashed lines.

Back to article page