Comparing the lowest energy binding pose of 18 to that of sulfopin, 52 an inhibitor of PIN1 that contains haloacetamide warhead, we found that the BDHI warhead can covalently engage C113 with binding driven by hydrogen bond interactions of the DHI ring with neighboring S115 (Figure 6C)
Amycretin has no separate component validation since it is a single molecule
The analysis script, custom developed for this study, was applied to all reconstructed slices to ensure consistency and reproducibility across the dataset
This pairing allows zinc to remain in the gastrointestinal tract for longer compared to zinc alone, supporting a slower and more sustained release
Wojtkowiak JW, Fouad F, LaLonde DT, Kleinman MD, Gibbs RA, Reiners JJ Jr, et al