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. 2022 Jan 31;23(3):1651. doi: 10.3390/ijms23031651

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© 2022 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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Graphical representation of docking study between NLRP3^PYD and (A,B) QM380, (C,D) QM381 (first poses) at the Ιa (A,C) and Ιb (B,D) interfaces, generated by Autodock Vina. In the peptide structures represented in cartoon form, residues that participated in the Ιa (helices 1 and 4) and Ιb (helix2) interfaces and ligands are in stick representation visualized by PYMOL (version.2.3.3).