The energetics of transmembrane helix insertion into a lipid bilayer.

The energetics of transmembrane helix insertion into a lipid bilayer.

Free energy profiles for insertion of a hydrophobic transmembrane protein α-helix (M2 from CFTR) into a lipid bilayer have been calculated using coarse-grained molecular dynamics simulations and umbrella sampling to yield potentials of mean force along a reaction path corresponding to translation of...

Full description

Bibliographic Details
Main Authors:	Chetwynd, A, Wee, C, Hall, B, Sansom, MS
Format:	Journal article
Language:	English
Published:	2010

Similar Items

Coarse-grained molecular dynamics simulations of the energetics of helix insertion into a lipid bilayer.
by: Bond, P, et al.
Published: (2008)

Computational studies of transmembrane helix insertion and association
by: Chetwynd, A
Published: (2011)

Membrane insertion of a voltage sensor helix.
by: Wee, C, et al.
Published: (2011)

A helix heterodimer in a lipid bilayer: prediction of the structure of an integrin transmembrane domain via multiscale simulations.
by: Kalli, A, et al.
Published: (2011)

Balancing force field protein-lipid interactions to capture transmembrane helix-helix association
by: Domański, J, et al.
Published: (2018)

DNA and lipid bilayers: self-assembly and insertion.
by: Khalid, S, et al.
Published: (2008)

Transmembrane helix-helix interactions: comparative simulations of the glycophorin a dimer.
by: Cuthbertson, J, et al.
Published: (2006)

Transmembrane helix dynamics of bacterial chemoreceptors supports a piston model of signalling
by: Hall, B, et al.
Published: (2011)

Transmembrane helix prediction: a comparative evaluation and analysis.
by: Cuthbertson, J, et al.
Published: (2005)

Interactions of a transmembrane helix and a membrane: Comparative simulations of bacteriorhodopsin helix A
by: Ulmschneider, M, et al.
Published: (2004)

Transmembrane helix : simple or complex
by: Wong, Wing-Cheong, et al.
Published: (2013)

Muscle-Specific Kinase Transmembrane Helices: Stability and Interactions in Detergent Micelles vs. Lipid Bilayers
by: Buyan, A, et al.
Published: (2013)

Transmembrane helix prediction. Evaluation of methods and genome wide analyses.
by: Cuthbertson, J, et al.
Published: (2004)

A steroid in a lipid bilayer: localization, orientation, and energetics.
by: Vijayan, R, et al.
Published: (2008)

Atomistic mechanism of transmembrane helix association
by: Domański, J, et al.
Published: (2020)

Structure and dynamics of the pore-lining helix of the nicotinic receptor: MD simulations in water, lipid bilayers, and transbilayer bundles.
by: Law, R, et al.
Published: (2000)

Changes in transmembrane helix alignment by arginine residues revealed by solid-state NMR experiments and coarse-grained MD simulations.
by: Vostrikov, V, et al.
Published: (2010)

The Transmembrane Conformation of the Influenza B Virus M2 Protein in Lipid Bilayers
by: Mandala, Venkata S, et al.
Published: (2021)

The Transmembrane Conformation of the Influenza B Virus M2 Protein in Lipid Bilayers
by: Mandala, Venkata S, et al.
Published: (2022)

Folding of apocytochrome c in lipid micelles: formation of alpha-helix precedes membrane insertion.
by: Bryson, E, et al.
Published: (1999)

Fluorinated amphiphiles control the insertion of α-hemolysin pores into lipid bilayers.
by: Raychaudhuri, P, et al.
Published: (2011)

Local Lipid Reorganization by a Transmembrane Protein Domain
by: Koldso, H, et al.
Published: (2012)

Energetics of [alpha]-helix formation in peptides and proteins
by: Schubert, Christian Reinhold
Published: (2009)

Lipid bilayer deformation and the free energy of interaction of a Kv channel gating-modifier toxin.
by: Wee, C, et al.
Published: (2008)

Following Natures Lead: On the Construction of Membrane-Inserted Toxins in Lipid Bilayer Nanodiscs
by: Akkaladevi, Narahari, et al.
Published: (2017)

The Roles of Transmembrane Domain Helix-III during Rhodopsin Photoactivation
by: Ou, Wen-bin, et al.
Published: (2011)

Monotopic enzymes and lipid bilayers: a comparative study.
by: Fowler, P, et al.
Published: (2007)

The flexing/twirling helix: Exploring the flexibility about molecular hinges formed by proline and glycine motifs in transmembrane helices
by: Bright, J, et al.
Published: (2003)

Helix-helix interactions in membrane proteins: coarse-grained simulations of glycophorin a helix dimerization.
by: Psachoulia, E, et al.
Published: (2008)

Structure and drug binding of the SARS-CoV-2 envelope protein transmembrane domain in lipid bilayers
by: Mandala, Venkata S, et al.
Published: (2022)

The interaction of C60 and its derivatives with a lipid bilayer via molecular dynamics simulations.
by: D'Rozario, R, et al.
Published: (2009)

Vstx1, a modifier of Kv channel gating, localizes to the interfacial region of lipid bilayers.
by: Bemporad, D, et al.
Published: (2006)

The energetics of protein-lipid interactions as viewed by molecular simulations
by: Corey, RA, et al.
Published: (2019)

Simulation studies of the interaction of antimicrobial peptides and lipid bilayers.
by: La Rocca, P, et al.
Published: (1999)

An intact IRE1 transmembrane domain is necessary for UPR activation upon lipid bilayer stress in S. cerevisiae
by: Ho, Nurulain
Published: (2020)

Lipid bilayer deformation and the free energy of interaction of a Kv channel gating−modifier toxin
by: Wee, C, et al.
Published: (2008)

SGTx1, a Kv channel gating-modifier toxin, binds to the interfacial region of lipid bilayers.
by: Wee, C, et al.
Published: (2007)

The role of extra-membranous inter-helical loops in helix-helix interactions.
by: Ulmschneider, M, et al.
Published: (2005)

Peptide nanopores and lipid bilayers: interactions by coarse-grained molecular-dynamics simulations.
by: Klingelhoefer, J, et al.
Published: (2009)

Molecular modeling correctly predicts the functional importance of Phe594 in transmembrane helix 11 of the multidrug resistance protein, MRP1 (ABCC1).
by: Campbell, J, et al.
Published: (2004)