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Global small-angle scattering data analysis of inverted hexagonal phases.

ABSTRACT: A global analysis model has been developed for randomly oriented, fully hydrated, inverted hexagonal (H_II) phases formed by many amphiphiles in aqueous solution, including membrane lipids. The model is based on a structure factor for hexagonally packed rods and a compositional model for the scattering length density, enabling also the analysis of positionally weakly correlated H_II phases. Bayesian probability theory was used for optimization of the adjustable parameters, which allows parameter correlations to be retrieved in much more detail than standard analysis techniques and thereby enables a realistic error analysis. The model was applied to different phosphatidylethanolamines, including previously unreported H_II data for diC14:0 and diC16:1 phosphatid-yl-ethanolamine. The extracted structural features include intrinsic lipid curvature, hydrocarbon chain length and area per lipid at the position of the neutral plane.

SUBMITTER: Frewein MPK

PROVIDER: S-EPMC6448687 | biostudies-literature | 2019 Apr

REPOSITORIES: biostudies-literature

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Global small-angle scattering data analysis of inverted hexagonal phases.

Frewein Moritz P K MPK Rumetshofer Michael M Pabst Georg G

Journal of applied crystallography 20190328 Pt 2

A global analysis model has been developed for randomly oriented, fully hydrated, inverted hexagonal (H<sub>II</sub>) phases formed by many amphiphiles in aqueous solution, including membrane lipids. The model is based on a structure factor for hexagonally packed rods and a compositional model for the scattering length density, enabling also the analysis of positionally weakly correlated H<sub>II</sub> phases. Bayesian probability theory was used for optimization of the adjustable parameters, wh ...[more]

PMID: 30996718

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