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. 2021 Jul 9;60(33):18231–18239. doi: 10.1002/anie.202105584

Figure 6.

Figure 6

High throughput crystallography of covalent library with SARS‐CoV‐2 3CLpro. A) Active site of 3CLpro (PDB ID 6Y2E).[26] The shape of the substrate pocket is indicated by the red dotted line. Cys145 is shown as yellow sticks. B) Examples of compounds giving a clear electron density: chloroacetamide F1 (PDB ID 7NUK); acrylic ester II‐F10 (PDB ID 7NT1); acrylic ester II‐G11 (PDB ID 7NT2); chloroacetamide F2 (PDB ID 7NTV); acrylamide F3 (PDB ID 7NT3); C) Table of inhibitions of cocrystallized compounds measured using a FRET assay. D) Representative FRET binding curve of compound F2.