Global small-angle X-ray scattering data analysis for multilamellar vesicles: the evolution of the scattering density profile model

被引:59
|
作者
Heftberger, Peter [1 ]
Kollmitzer, Benjamin [1 ]
Heberle, Frederick A. [2 ]
Pan, Jianjun [2 ,3 ]
Rappolt, Michael [4 ,5 ]
Amenitsch, Heinz [4 ]
Kucerka, Norbert [6 ]
Katsaras, John [2 ,7 ,8 ,9 ]
Pabst, Georg [1 ]
机构
[1] Graz Univ, Inst Mol Biosci, Div Biophys, A-8010 Graz, Austria
[2] Oak Ridge Natl Lab, Biol & Soft Matter Div, Oak Ridge, TN USA
[3] Univ S Florida, Dept Phys, Tampa, FL 33620 USA
[4] Graz Univ Technol, Inst Inorgan Chem, A-8010 Graz, Austria
[5] Univ Leeds, Sch Food Sci & Nutr, Leeds LS2 9JT, W Yorkshire, England
[6] CNR, Canadian Neutron Beam Ctr, Chalk River, ON, Canada
[7] Joint Inst Neutron Sci, Oak Ridge, TN USA
[8] Univ Tennessee, Dept Phys & Astron, Knoxville, TN 37996 USA
[9] Brock Univ, Dept Phys, St Catharines, ON L2S 3A1, Canada
来源
JOURNAL OF APPLIED CRYSTALLOGRAPHY | 2014年 / 47卷
基金
奥地利科学基金会;
关键词
MOLECULAR-DYNAMICS SIMULATIONS; LIPID-BILAYER STRUCTURE; UNILAMELLAR VESICLES; PHASE DMPC; CHOLESTEROL; NEUTRON; MEMBRANES; PHOSPHATIDYLCHOLINES; PHOSPHOLIPIDS; FLUCTUATIONS;
D O I
10.1107/S1600576713029798
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
The highly successful scattering density profile (SDP) model, used to jointly analyze small-angle X-ray and neutron scattering data from unilamellar vesicles, has been adapted for use with data from fully hydrated, liquid crystalline multilamellar vesicles (MLVs). Using a genetic algorithm, this new method is capable of providing high-resolution structural information, as well as determining bilayer elastic bending fluctuations from standalone X-ray data. Structural parameters such as bilayer thickness and area per lipid were determined for a series of saturated and unsaturated lipids, as well as binary mixtures with cholesterol. The results are in good agreement with previously reported SDP data, which used both neutron and X-ray data. The inclusion of deuterated and non-deuterated MLV neutron data in the analysis improved the lipid backbone information but did not improve, within experimental error, the structural data regarding bilayer thickness and area per lipid.
引用
收藏
页码:173 / 180
页数:8
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