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Published in 2022 at "Journal of Chemical Theory and Computation"
DOI: 10.1021/acs.jctc.1c00708
Abstract: Lipids play important modulatory and structural roles for membrane proteins. Molecular dynamics simulations are frequently used to provide insights into the nature of these protein–lipid interactions. Systematic comparative analysis requires tools that provide algorithms for…
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Keywords:
dynamics simulations;
lipid interactions;
protein lipid;
molecular dynamics ... See more keywords
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Published in 2022 at "ACS chemical neuroscience"
DOI: 10.1021/acschemneuro.2c00422
Abstract: The interaction of lipids with G-protein-coupled receptors (GPCRs) has been shown to modulate and dictate several aspects of GPCR organization and function. Diverse lipid interaction sites have been identified from structural biology, bioinformatics, and molecular…
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Keywords:
serotonin1a receptor;
interaction sites;
lipid interactions;
cholesterol ... See more keywords
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Published in 2018 at "Nature Communications"
DOI: 10.1038/s41467-018-06704-1
Abstract: Secondary transporters undergo structural rearrangements to catalyze substrate translocation across the cell membrane – yet how such conformational changes happen within a lipid environment remains poorly understood. Here, we combine hydrogen-deuterium exchange mass spectrometry (HDX-MS)…
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Keywords:
protein lipid;
conformational landscape;
direct protein;
secondary transporters ... See more keywords
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Published in 2019 at "Nature Communications"
DOI: 10.1038/s41467-019-11268-9
Abstract: One enigma in biology is the generation, sensing and maintenance of membrane curvature. Curvature-mediating proteins have been shown to induce specific membrane shapes by direct insertion and nanoscopic scaffolding, while the cytoskeletal motors exert forces…
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Keywords:
mechanism;
membrane sculpting;
geometry;
biology ... See more keywords
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Published in 2022 at "Biochemical Society Transactions"
DOI: 10.1042/bst20200884
Abstract: Defensins are a class of host defence peptides (HDPs) that often harbour antimicrobial and anticancer activities, making them attractive candidates as novel therapeutics. In comparison with current antimicrobial and cancer treatments, defensins uniquely target specific…
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Keywords:
antimicrobial anticancer;
defensin lipid;
membrane targeting;
lipid interactions ... See more keywords
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Published in 2022 at "Langmuir"
DOI: 10.1101/2022.12.12.520108
Abstract: The lining of the alveoli is covered by pulmonary surfactant, a complex mixture of surface-active lipids and proteins that enables efficient gas exchange between inhaled air and the circulation. Despite decades of advancements in the…
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Keywords:
lipid interactions;
microscopy;
lipids proteins;
surfactant proteins ... See more keywords
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Published in 2023 at "Frontiers in Chemistry"
DOI: 10.3389/fchem.2022.1088058
Abstract: Lipids, the structural part of membranes, play important roles in biological functions. However, our understanding of their implication in key cellular processes such as cell division and protein-lipid interaction is just emerging. This is the…
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Keywords:
lipid interactions;
protein lipid;
molecular fingerprint;
modeling molecular ... See more keywords
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Published in 2022 at "Plants"
DOI: 10.3390/plants11141809
Abstract: Plant polyphenols have many potential applications, for example, in the fields of chemical ecology and human and animal health and nutrition. These biological benefits are related to their bioavailability, bioaccessibility and interactions with other biomolecules,…
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Keywords:
lipid interactions;
chemical methods;
polyphenol lipid;
interactions chemical ... See more keywords
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Published in 2020 at "General physiology and biophysics"
DOI: 10.4149/gpb_2019063
Abstract: The current strategies to eradicate bacteria require that the antimicrobial agent either penetrate or disrupt the bacterial membrane. In Escherichia coli (E.coli) as a model of Gram-negative strains, the antimicrobials have to cross two barriers…
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Keywords:
inner membrane;
escherichia coli;
human physiological;
lipid lipid ... See more keywords