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    Lung surfactant monolayer A good natural barrier against dibenzo-p-dioxins

    Year: 2020

    Journal: Chemosphere, Volume 240, FEB

    Authors: Stachowicz-Kusnierz, A; Seidler, T; Rogalska, E; Korchowiec, J; Korchowiec, B

    Organizations: Polish National Science Centre [UM0-2014/13/B/ST4/04995]; European Regional Development FundEuropean Commission [OIG.02.01.00-12-023/08]; HPC Infrastructure for Grand Challenges of Science and Engineering project

    Keywords: Lung surfactant; Air pollution; Dibenzo-p-dioxin; 2-Chlorodibenzo-p-dioxin; Pi-A isotherms; PM-IRRAS; Molecular dynamics

    The present study deals with interaction of two air pollutants: dibenzodioxin, DD, and its' monochlorinated derivative, 2-chlorodibenzodioxin, 2CLDD, with models of the lung surfactant (LS) system. A monolayer composed of DPPC and POPC in 1:1 molar ratio was used as a model of LS. One component monolayers of DPPC and POPC were also examined, to model the interiors of LC and LE domains in LS, respectively. Molecular dynamics simulations and measurements of surface pressure isotherms, as well as polarization modulation-infrared reflection-absorption spectra were employed to study the influence of dioxins on the monolayers. We demonstrate, that both dioxins adsorb and accumulate in the hydrophobic parts of all three monolayers. DD molecules prefer flat orientation on the surface at large areas. Upon compression, they lift and orient perpendicularly to the monolayer. Flat orientation of DD molecules leads to their large surface area. In consequence they preferentially locate in vicinity of unsaturated chains of POPC - they are small enough to fill void spaces created by kinks in unsaturated chains. 2CLDD orient along monolayer normal already at the largest areas and preference for POPC was not observed for them. In laterally relaxed states, a condensing effect, connected with reduction of surface area available to the lipids was observed for both dioxins. In the case of 2CLDD, additional locally ordering influence of dioxin molecules was detected. In compressed states, the presence of dioxin molecules hinders alignment and uniform ordering of lipid chains. (C) 2019 Elsevier Ltd. All rights reserved.
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