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. 2023 Apr 5;66(8):5364–5376. doi: 10.1021/acs.jmedchem.3c00097

Figure 8.

Figure 8

Cartoon representation of the complex between Bothrops pirajai PrTX-II and a fatty acid (tridecanoic acid) (PDB 1QLL).77 A close-up view of the binding site of PrTX-II, with the fatty acid molecule stabilized by a hydrogen bond with the Cys29–Gly30 peptide bond, which is hyperpolarized by the Lys122, increasing its affinity for the fatty acid. The Ca2+ binding loop interactions with the Nε atom of the Lys49 residue are also shown. PyMOL molecular graphics software package was used to generate the representations.