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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...
Autores principales: | , , , |
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Formato: | Texto |
Lenguaje: | English |
Publicado: |
International Union of Crystallography
2009
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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. |
format | Text |
id | pubmed-2703568 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2009 |
publisher | International Union of Crystallography |
record_format | MEDLINE/PubMed |
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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