Multiscale simulations of biological membranes: the challenge to understand biological phenomena in a living substance

G Enkavi, M Javanainen, W Kulig, T Róg… - Chemical …, 2019 - ACS Publications
Biological membranes are tricky to investigate. They are complex in terms of molecular
composition and structure, functional over a wide range of time scales, and characterized by …

Selective regulation of macrophage lipid metabolism via nanomaterials' surface chemistry

J Wu, X Bai, L Yan, D Baimanov, Y Cong… - Nature …, 2024 - nature.com
Understanding the interface between nanomaterials and lipoproteins is crucial for gaining
insights into their impact on lipoprotein structure and lipid metabolism. Here, we use …

[HTML][HTML] Molecular dynamics simulations of lipid nanodiscs

M Pourmousa, RW Pastor - Biochimica et Biophysica Acta (BBA) …, 2018 - Elsevier
A lipid nanodisc is a discoidal lipid bilayer stabilized by proteins, peptides, or polymers on its
edge. Nanodiscs have two important connections to structural biology. The first is associated …

Interdigitation between triglycerides and lipids modulates surface properties of lipid droplets

A Bacle, R Gautier, CL Jackson, PFJ Fuchs, S Vanni - Biophysical journal, 2017 - cell.com
Intracellular lipid droplets (LDs) are the main cellular site of metabolic energy storage. Their
structure is unique inside the cell, with a core of esterified fatty acids and sterols, mainly …

[HTML][HTML] Unravelling the influence of surface lipids on the structure, dynamics and interactome of high-density lipoproteins

CJ Malajczuk, RL Mancera - Biochimica et Biophysica Acta (BBA) …, 2023 - Elsevier
Surface lipids influence the biological activities of high-density lipoproteins (HDLs) but their
species-specific effects on HDL structure, dynamics, and surface interactome has remained …

The surface and hydration properties of lipid droplets

S Kim, JMJ Swanson - Biophysical Journal, 2020 - cell.com
Lipid droplets (LDs) are energy storage organelles composed of neutral lipids, such as
triacylglycerol (TG) and sterol esters, surrounded by a phospholipid (PL) monolayer. Their …

Eicosapentaenoic and docosahexaenoic acid supplementation increases HDL Content in n-3 fatty acids and improves endothelial function in hypertriglyceridemic …

P Peña-De-La-Sancha, A Muñoz-García… - International Journal of …, 2023 - mdpi.com
High-density lipoproteins (HDLs) are known to enhance vascular function through different
mechanisms, including the delivery of functional lipids to endothelial cells. Therefore, we …

[HTML][HTML] Structure and intermolecular interactions in spheroidal high-density lipoprotein subpopulations

CJ Malajczuk, NS Gandhi, RL Mancera - Journal of structural biology: X, 2021 - Elsevier
Human serum high-density lipoproteins (HDLs) are a population of small, dense protein-
lipid aggregates that are crucial for intravascular lipid trafficking and are protective against …

[HTML][HTML] Computational studies of plasma lipoprotein lipids

L Pan, JP Segrest - Biochimica et Biophysica Acta (BBA)-Biomembranes, 2016 - Elsevier
Plasma lipoproteins are macromolecular assemblies of proteins and lipids found in the
blood. The lipid components of lipoproteins are amphipathic lipids such as phospholipids …

Mechanistic Insights into the Activation of Lecithin–Cholesterol Acyltransferase in Therapeutic Nanodiscs Composed of Apolipoprotein AI Mimetic Peptides and …

L Giorgi, A Niemela, EP Kumpula, O Natri… - Molecular …, 2022 - ACS Publications
The mechanistic details behind the activation of lecithin–cholesterol acyltransferase (LCAT)
by apolipoprotein AI (apoA-I) and its mimetic peptides are still enigmatic. Resolving the …