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. 2021 Aug 22;22(16):9057. doi: 10.3390/ijms22169057

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© 2021 by the authors.

Licensee MDPI, Basel, Switzerland. This article is an open access article distributed under the terms and conditions of the Creative Commons Attribution (CC BY) license (https://creativecommons.org/licenses/by/4.0/).

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Molecular docking of compounds M1–5 compared to Compound 13 with SARS-CoV-2 M^pro (PDB: 6LU7). (A) The interaction of Compound 13 (green stick) within the active site of M^PRO. (B) The interaction of M3 (purple stick) within the active site of M^pro. (C) The interaction of M1 (cyan stick) within the active site of M^PRO. (D) The interaction of M2 (orange stick) within the active site of M^pro. (E) The interaction of M4 (light green stick) within the active site of M^pro. (F) The interaction of M5 (pink stick) within the active site of M^pro.