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Vazquez, D. S.

Publications and source records attributed to Vazquez, D. S..

2 recordsLinked to original sources

The immunogenic 33-mer gliadin peptide attenuates flagellin-induced TLR5/NF-κB signaling

Wheat gluten is the main trigger of gluten-related disorders such as celiac disease, in which the proteolysis-resistant, 33-mer peptide is a key immunodominant factor. It has been reported that the 33-mer forms oligomers and thin-plate superstructures that accumulate in the Caco-2 intestinal epithelial cell line, although their biological effects remain only partially understood. Here, we screened the effects of these nanostructures on Toll-like receptors in Caco-2 cells to investigate their effect on the early innate immune response. Our findings showed a specific upregulation of TLR5 mRNA in response to 33-mer gliadin superstructures, although no inflammatory response was detected based on CXCL1 and CXCL8 levels. Moreover, immunofluorescence analysis revealed partial co-localization with TLR5. We further found that the 33-mer superstructures attenuate flagellin-induced TLR5/NF{kappa}B signaling in reporter cells, similar to a blocking anti-hTLR5-IgA2 antibody. Molecular docking suggested that the 33-mer peptide occupies the concave region of TLR5 as well as 54% of the TLR5-TLR5 dimerization interface. The interference with the TLR5 dimerization domain could explain the experimental attenuation of flagellin-mediated TLR5 activation. Given that TLR5 contributes not only to inflammation but also to intestinal homeostasis, our findings suggest that the formation of 33-mer nanostructures upon its accumulation may increase the local concentration of 33-mer, interfering with TLR5-mediated mucosal immune responses. These findings provide a rationale for investigating the role of TLR5 and 33-mer aggregates in clinical samples from patients with celiac disease and other gluten-related disorders.

immunology↗

Exploring the Conformational Transition Between the Fully Folded and Locally Unfolded Substates of the Escherichia coli Thiol Peroxidase

Thiol peroxidase from Escherichia coli (EcTPx) is a peroxiredoxin that catalyzes the reduction of different hydroperoxides. During the catalytic cycle of EcTPx, the peroxidatic cysteine (CP) is oxidized to a sulfenic acid by peroxide, then the resolving cysteine (CR) condenses with the sulfenic acid of CP to form a disulfide bond, which is finally reduced by thioredoxin. Purified EcTPx as dithiol and disulfide behaves as a monomer in close to physiological conditions. Although secondary structure rearrangements are present when comparing different redox states of the enzyme, no significant differences in unfolding free energies are observed under reducing and oxidizing conditions. A conformational change denominated fully folded (FF) to locally unfolded (LU) transition, involving a partial unfolding of H2 and H3 helices, must occur to enable the formation of the disulfide bond since the catalytic cysteines are 12 [A] apart in the FF conformation of EcTPx. To explore this crucial process, the mechanism of the FF[->]LU and the LU[->]FF transitions were studied using long time scale conventional molecular dynamic simulations and an enhanced conformational sampling technique for different oxidation and protonation states of CP and/or CR. Our results suggest that the FF[->]LU transition has a higher associated energy barrier than the refolding LU[->]FF process in agreement with the relatively slow experimental turnover number of EcTPx. Furthermore, in silico designed single-point mutants of the H3 enhanced locally unfolding events, suggesting that the native FF interactions in the active site are not evolutionary optimized to fully speed-up the conformational transition of wild-type EcTPx.

biophysics↗