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Journal article

Water and hydrophobic gates in ion channels and nanopores

Abstract:

Ion channel proteins form nanopores in biological membranes which allow the passage of ions and water molecules. Hydrophobic constrictions in such pores can form gates, i.e. energetic barriers to water and ion permeation. Molecular dynamics simulations of water in ion channels may be used to assess whether a hydrophobic gate is closed (i.e. impermeable to ions) or open. If there is an energetic barrier to water permeation then it is likely that a gate will also be impermeable to ions. Simulat...

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Publication status:
Published
Peer review status:
Peer reviewed

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Publisher copy:
10.1039/C8FD00013A

Authors


More by this author
Institution:
University of Oxford
Division:
Medical Sciences Division
Department:
Biochemistry
Role:
Author
More by this author
Institution:
University of Oxford
Division:
Medical Sciences Division
Department:
Biochemistry
Role:
Author
More by this author
Institution:
University of Oxford
Division:
Medical Sciences Division
Department:
Biochemistry
Role:
Author
More by this author
Institution:
University of Oxford
Division:
Medical Sciences Division
Department:
Biochemistry
Role:
Author
Publisher:
Royal Society of Chemistry Publisher's website
Journal:
Faraday Discussions Journal website
Volume:
209
Pages:
231-247
Publication date:
2018-04-16
Acceptance date:
2018-02-13
DOI:
EISSN:
1364-549
ISSN:
1359-6640
Pubs id:
pubs:824424
UUID:
uuid:02c3e394-c074-4173-8e7d-52be78153a83
Local pid:
pubs:824424
Source identifiers:
824424
Deposit date:
2018-02-14

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