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Unit-cell determination from randomly oriented electron-diffraction patterns

Unit-cell determination is the first step towards the structure solution of an unknown crystal form. Standard procedures for unit-cell determination cannot cope with data collections that consist of single diffraction patterns of multiple crystals, each with an unknown orientation. However, for beam...

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Detalles Bibliográficos
Autores principales: Jiang, Linhua, Georgieva, Dilyana, Zandbergen, Henny W., Abrahams, Jan Pieter
Formato: Texto
Lenguaje:English
Publicado: International Union of Crystallography 2009
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2703568/
https://www.ncbi.nlm.nih.gov/pubmed/19564682
http://dx.doi.org/10.1107/S0907444909003163
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author Jiang, Linhua
Georgieva, Dilyana
Zandbergen, Henny W.
Abrahams, Jan Pieter
author_facet Jiang, Linhua
Georgieva, Dilyana
Zandbergen, Henny W.
Abrahams, Jan Pieter
author_sort Jiang, Linhua
collection PubMed
description Unit-cell determination is the first step towards the structure solution of an unknown crystal form. Standard procedures for unit-cell determination cannot cope with data collections that consist of single diffraction patterns of multiple crystals, each with an unknown orientation. However, for beam-sensitive nanocrystals these are often the only data that can be obtained. An algorithm for unit-cell determination that uses randomly oriented electron-diffraction patterns with unknown angular relationships is presented here. The algorithm determined the unit cells of mineral, pharmaceutical and protein nanocrystals in orthorhombic high- and low-symmetry space groups, allowing (well oriented) patterns to be indexed.
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spelling pubmed-27035682009-07-01 Unit-cell determination from randomly oriented electron-diffraction patterns Jiang, Linhua Georgieva, Dilyana Zandbergen, Henny W. Abrahams, Jan Pieter Acta Crystallogr D Biol Crystallogr New Algorithms Workshop Unit-cell determination is the first step towards the structure solution of an unknown crystal form. Standard procedures for unit-cell determination cannot cope with data collections that consist of single diffraction patterns of multiple crystals, each with an unknown orientation. However, for beam-sensitive nanocrystals these are often the only data that can be obtained. An algorithm for unit-cell determination that uses randomly oriented electron-diffraction patterns with unknown angular relationships is presented here. The algorithm determined the unit cells of mineral, pharmaceutical and protein nanocrystals in orthorhombic high- and low-symmetry space groups, allowing (well oriented) patterns to be indexed. International Union of Crystallography 2009-07-01 2009-06-20 /pmc/articles/PMC2703568/ /pubmed/19564682 http://dx.doi.org/10.1107/S0907444909003163 Text en © International Union of Crystallography 2009 http://journals.iucr.org/services/termsofuse.html This is an open-access article distributed under the terms described at http://journals.iucr.org/services/termsofuse.html.
spellingShingle New Algorithms Workshop
Jiang, Linhua
Georgieva, Dilyana
Zandbergen, Henny W.
Abrahams, Jan Pieter
Unit-cell determination from randomly oriented electron-diffraction patterns
title Unit-cell determination from randomly oriented electron-diffraction patterns
title_full Unit-cell determination from randomly oriented electron-diffraction patterns
title_fullStr Unit-cell determination from randomly oriented electron-diffraction patterns
title_full_unstemmed Unit-cell determination from randomly oriented electron-diffraction patterns
title_short Unit-cell determination from randomly oriented electron-diffraction patterns
title_sort unit-cell determination from randomly oriented electron-diffraction patterns
topic New Algorithms Workshop
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC2703568/
https://www.ncbi.nlm.nih.gov/pubmed/19564682
http://dx.doi.org/10.1107/S0907444909003163
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AT abrahamsjanpieter unitcelldeterminationfromrandomlyorientedelectrondiffractionpatterns