Perdeuteration: improved visualization of solvent structure in neutron macromolecular crystallography
- Autores
- Fisher, S. J.; Blakeley, M. P.; Howard, Eduardo Ignacio; Petit Haertlein, I.; Haertlein, M.; Mitschler, A.; Cousido Siah, A.; Salvay, Andrés Gerardo; Popov, A.; Muller Dieckmann, C.; Petrova, T.; Podjarny, A.
- Año de publicación
- 2014
- Idioma
- inglés
- Tipo de recurso
- artículo
- Estado
- versión publicada
- Descripción
- The 1.8 Å resolution neutron structure of deuterated type III antifreeze protein in which the methyl groups of leucine and valine residues are selectively protonated is presented. Comparison between this and the 1.85 Å resolution neutron structure of perdeuterated type III antifreeze protein indicates that perdeuteration improves the visibility of solvent molecules located in close vicinity to hydrophobic residues, as cancellation effects between H atoms of the methyl groups and nearby heavy-water molecules (D2O) are avoided.
Fil: Fisher, S. J.. Institut Laue Langevin; Francia. University of Salzburg; Alemania
Fil: Blakeley, M. P.. Institut Laue Langevin; Francia
Fil: Howard, Eduardo Ignacio. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - La Plata. Instituto de Física de Líquidos y Sistemas Biológicos. Universidad Nacional de La Plata. Facultad de Ciencias Exactas. Instituto de Física de Líquidos y Sistemas Biológicos; Argentina
Fil: Petit Haertlein, I.. Institut Laue Langevin; Francia
Fil: Haertlein, M.. Institut Laue Langevin; Francia
Fil: Mitschler, A.. Université de Strasbourg; Francia
Fil: Cousido Siah, A.. Université de Strasbourg; Francia
Fil: Salvay, Andrés Gerardo. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - La Plata. Instituto de Física de Líquidos y Sistemas Biológicos. Universidad Nacional de La Plata. Facultad de Ciencias Exactas. Instituto de Física de Líquidos y Sistemas Biológicos; Argentina. Universidad Nacional de Quilmes; Argentina
Fil: Popov, A.. European Synchrotron Radiation; Francia
Fil: Muller Dieckmann, C.. European Synchrotron Radiation; Francia
Fil: Petrova, T.. Russian Academy of Sciences; Rusia
Fil: Podjarny, A.. Université de Strasbourg; Francia - Materia
-
Neutron Macromolecular Crystallography
Perdeuteration
Solvent Visibility - Nivel de accesibilidad
- acceso abierto
- Condiciones de uso
- https://creativecommons.org/licenses/by-nc-sa/2.5/ar/
- Repositorio
- Institución
- Consejo Nacional de Investigaciones Científicas y Técnicas
- OAI Identificador
- oai:ri.conicet.gov.ar:11336/34284
Ver los metadatos del registro completo
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CONICET Digital (CONICET) |
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Perdeuteration: improved visualization of solvent structure in neutron macromolecular crystallographyFisher, S. J.Blakeley, M. P.Howard, Eduardo IgnacioPetit Haertlein, I.Haertlein, M.Mitschler, A.Cousido Siah, A.Salvay, Andrés GerardoPopov, A.Muller Dieckmann, C.Petrova, T.Podjarny, A.Neutron Macromolecular CrystallographyPerdeuterationSolvent Visibilityhttps://purl.org/becyt/ford/1.3https://purl.org/becyt/ford/1https://purl.org/becyt/ford/1.6https://purl.org/becyt/ford/1The 1.8 Å resolution neutron structure of deuterated type III antifreeze protein in which the methyl groups of leucine and valine residues are selectively protonated is presented. Comparison between this and the 1.85 Å resolution neutron structure of perdeuterated type III antifreeze protein indicates that perdeuteration improves the visibility of solvent molecules located in close vicinity to hydrophobic residues, as cancellation effects between H atoms of the methyl groups and nearby heavy-water molecules (D2O) are avoided.Fil: Fisher, S. J.. Institut Laue Langevin; Francia. University of Salzburg; AlemaniaFil: Blakeley, M. P.. Institut Laue Langevin; FranciaFil: Howard, Eduardo Ignacio. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - La Plata. Instituto de Física de Líquidos y Sistemas Biológicos. Universidad Nacional de La Plata. Facultad de Ciencias Exactas. Instituto de Física de Líquidos y Sistemas Biológicos; ArgentinaFil: Petit Haertlein, I.. Institut Laue Langevin; FranciaFil: Haertlein, M.. Institut Laue Langevin; FranciaFil: Mitschler, A.. Université de Strasbourg; FranciaFil: Cousido Siah, A.. Université de Strasbourg; FranciaFil: Salvay, Andrés Gerardo. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - La Plata. Instituto de Física de Líquidos y Sistemas Biológicos. Universidad Nacional de La Plata. Facultad de Ciencias Exactas. Instituto de Física de Líquidos y Sistemas Biológicos; Argentina. Universidad Nacional de Quilmes; ArgentinaFil: Popov, A.. European Synchrotron Radiation; FranciaFil: Muller Dieckmann, C.. European Synchrotron Radiation; FranciaFil: Petrova, T.. Russian Academy of Sciences; RusiaFil: Podjarny, A.. Université de Strasbourg; FranciaWiley2014-12info:eu-repo/semantics/articleinfo:eu-repo/semantics/publishedVersionhttp://purl.org/coar/resource_type/c_6501info:ar-repo/semantics/articuloapplication/pdfapplication/pdfapplication/pdfhttp://hdl.handle.net/11336/34284Fisher, S. J.; Blakeley, M. P.; Howard, Eduardo Ignacio; Petit Haertlein, I.; Haertlein, M.; et al.; Perdeuteration: improved visualization of solvent structure in neutron macromolecular crystallography; Wiley; Acta Crystallographica Section D-biological Crystallography; 70; 12; 12-2014; 3266-32720907-4449CONICET DigitalCONICETenginfo:eu-repo/semantics/altIdentifier/url/http://onlinelibrary.wiley.com/doi/10.1107/S1399004714021610/abstractinfo:eu-repo/semantics/altIdentifier/doi/10.1107/S1399004714021610info:eu-repo/semantics/openAccesshttps://creativecommons.org/licenses/by-nc-sa/2.5/ar/reponame:CONICET Digital (CONICET)instname:Consejo Nacional de Investigaciones Científicas y Técnicas2025-09-29T10:32:23Zoai:ri.conicet.gov.ar:11336/34284instacron:CONICETInstitucionalhttp://ri.conicet.gov.ar/Organismo científico-tecnológicoNo correspondehttp://ri.conicet.gov.ar/oai/requestdasensio@conicet.gov.ar; lcarlino@conicet.gov.arArgentinaNo correspondeNo correspondeNo correspondeopendoar:34982025-09-29 10:32:24.057CONICET Digital (CONICET) - Consejo Nacional de Investigaciones Científicas y Técnicasfalse |
dc.title.none.fl_str_mv |
Perdeuteration: improved visualization of solvent structure in neutron macromolecular crystallography |
title |
Perdeuteration: improved visualization of solvent structure in neutron macromolecular crystallography |
spellingShingle |
Perdeuteration: improved visualization of solvent structure in neutron macromolecular crystallography Fisher, S. J. Neutron Macromolecular Crystallography Perdeuteration Solvent Visibility |
title_short |
Perdeuteration: improved visualization of solvent structure in neutron macromolecular crystallography |
title_full |
Perdeuteration: improved visualization of solvent structure in neutron macromolecular crystallography |
title_fullStr |
Perdeuteration: improved visualization of solvent structure in neutron macromolecular crystallography |
title_full_unstemmed |
Perdeuteration: improved visualization of solvent structure in neutron macromolecular crystallography |
title_sort |
Perdeuteration: improved visualization of solvent structure in neutron macromolecular crystallography |
dc.creator.none.fl_str_mv |
Fisher, S. J. Blakeley, M. P. Howard, Eduardo Ignacio Petit Haertlein, I. Haertlein, M. Mitschler, A. Cousido Siah, A. Salvay, Andrés Gerardo Popov, A. Muller Dieckmann, C. Petrova, T. Podjarny, A. |
author |
Fisher, S. J. |
author_facet |
Fisher, S. J. Blakeley, M. P. Howard, Eduardo Ignacio Petit Haertlein, I. Haertlein, M. Mitschler, A. Cousido Siah, A. Salvay, Andrés Gerardo Popov, A. Muller Dieckmann, C. Petrova, T. Podjarny, A. |
author_role |
author |
author2 |
Blakeley, M. P. Howard, Eduardo Ignacio Petit Haertlein, I. Haertlein, M. Mitschler, A. Cousido Siah, A. Salvay, Andrés Gerardo Popov, A. Muller Dieckmann, C. Petrova, T. Podjarny, A. |
author2_role |
author author author author author author author author author author author |
dc.subject.none.fl_str_mv |
Neutron Macromolecular Crystallography Perdeuteration Solvent Visibility |
topic |
Neutron Macromolecular Crystallography Perdeuteration Solvent Visibility |
purl_subject.fl_str_mv |
https://purl.org/becyt/ford/1.3 https://purl.org/becyt/ford/1 https://purl.org/becyt/ford/1.6 https://purl.org/becyt/ford/1 |
dc.description.none.fl_txt_mv |
The 1.8 Å resolution neutron structure of deuterated type III antifreeze protein in which the methyl groups of leucine and valine residues are selectively protonated is presented. Comparison between this and the 1.85 Å resolution neutron structure of perdeuterated type III antifreeze protein indicates that perdeuteration improves the visibility of solvent molecules located in close vicinity to hydrophobic residues, as cancellation effects between H atoms of the methyl groups and nearby heavy-water molecules (D2O) are avoided. Fil: Fisher, S. J.. Institut Laue Langevin; Francia. University of Salzburg; Alemania Fil: Blakeley, M. P.. Institut Laue Langevin; Francia Fil: Howard, Eduardo Ignacio. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - La Plata. Instituto de Física de Líquidos y Sistemas Biológicos. Universidad Nacional de La Plata. Facultad de Ciencias Exactas. Instituto de Física de Líquidos y Sistemas Biológicos; Argentina Fil: Petit Haertlein, I.. Institut Laue Langevin; Francia Fil: Haertlein, M.. Institut Laue Langevin; Francia Fil: Mitschler, A.. Université de Strasbourg; Francia Fil: Cousido Siah, A.. Université de Strasbourg; Francia Fil: Salvay, Andrés Gerardo. Consejo Nacional de Investigaciones Científicas y Técnicas. Centro Científico Tecnológico Conicet - La Plata. Instituto de Física de Líquidos y Sistemas Biológicos. Universidad Nacional de La Plata. Facultad de Ciencias Exactas. Instituto de Física de Líquidos y Sistemas Biológicos; Argentina. Universidad Nacional de Quilmes; Argentina Fil: Popov, A.. European Synchrotron Radiation; Francia Fil: Muller Dieckmann, C.. European Synchrotron Radiation; Francia Fil: Petrova, T.. Russian Academy of Sciences; Rusia Fil: Podjarny, A.. Université de Strasbourg; Francia |
description |
The 1.8 Å resolution neutron structure of deuterated type III antifreeze protein in which the methyl groups of leucine and valine residues are selectively protonated is presented. Comparison between this and the 1.85 Å resolution neutron structure of perdeuterated type III antifreeze protein indicates that perdeuteration improves the visibility of solvent molecules located in close vicinity to hydrophobic residues, as cancellation effects between H atoms of the methyl groups and nearby heavy-water molecules (D2O) are avoided. |
publishDate |
2014 |
dc.date.none.fl_str_mv |
2014-12 |
dc.type.none.fl_str_mv |
info:eu-repo/semantics/article info:eu-repo/semantics/publishedVersion http://purl.org/coar/resource_type/c_6501 info:ar-repo/semantics/articulo |
format |
article |
status_str |
publishedVersion |
dc.identifier.none.fl_str_mv |
http://hdl.handle.net/11336/34284 Fisher, S. J.; Blakeley, M. P.; Howard, Eduardo Ignacio; Petit Haertlein, I.; Haertlein, M.; et al.; Perdeuteration: improved visualization of solvent structure in neutron macromolecular crystallography; Wiley; Acta Crystallographica Section D-biological Crystallography; 70; 12; 12-2014; 3266-3272 0907-4449 CONICET Digital CONICET |
url |
http://hdl.handle.net/11336/34284 |
identifier_str_mv |
Fisher, S. J.; Blakeley, M. P.; Howard, Eduardo Ignacio; Petit Haertlein, I.; Haertlein, M.; et al.; Perdeuteration: improved visualization of solvent structure in neutron macromolecular crystallography; Wiley; Acta Crystallographica Section D-biological Crystallography; 70; 12; 12-2014; 3266-3272 0907-4449 CONICET Digital CONICET |
dc.language.none.fl_str_mv |
eng |
language |
eng |
dc.relation.none.fl_str_mv |
info:eu-repo/semantics/altIdentifier/url/http://onlinelibrary.wiley.com/doi/10.1107/S1399004714021610/abstract info:eu-repo/semantics/altIdentifier/doi/10.1107/S1399004714021610 |
dc.rights.none.fl_str_mv |
info:eu-repo/semantics/openAccess https://creativecommons.org/licenses/by-nc-sa/2.5/ar/ |
eu_rights_str_mv |
openAccess |
rights_invalid_str_mv |
https://creativecommons.org/licenses/by-nc-sa/2.5/ar/ |
dc.format.none.fl_str_mv |
application/pdf application/pdf application/pdf |
dc.publisher.none.fl_str_mv |
Wiley |
publisher.none.fl_str_mv |
Wiley |
dc.source.none.fl_str_mv |
reponame:CONICET Digital (CONICET) instname:Consejo Nacional de Investigaciones Científicas y Técnicas |
reponame_str |
CONICET Digital (CONICET) |
collection |
CONICET Digital (CONICET) |
instname_str |
Consejo Nacional de Investigaciones Científicas y Técnicas |
repository.name.fl_str_mv |
CONICET Digital (CONICET) - Consejo Nacional de Investigaciones Científicas y Técnicas |
repository.mail.fl_str_mv |
dasensio@conicet.gov.ar; lcarlino@conicet.gov.ar |
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1844614337323335680 |
score |
13.070432 |