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Parallel NMR Supersequences: Ten Spectra in a Single Measurement
[Image: see text] The principles employed in parallel NMR and MRI are applied to NMR supersequences yielding as many as ten 2D NMR spectra in one measurement. We present a number of examples where two NOAH (NMR by Ordered Acquisition using (1)H-detection) supersequences are recorded in parallel, thu...
Autores principales: | , , , |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
American Chemical Society
2021
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8611666/ https://www.ncbi.nlm.nih.gov/pubmed/34841408 http://dx.doi.org/10.1021/jacsau.1c00423 |
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author | Kupče, Ēriks Yong, Jonathan R. J. Widmalm, Göran Claridge, Tim D. W. |
author_facet | Kupče, Ēriks Yong, Jonathan R. J. Widmalm, Göran Claridge, Tim D. W. |
author_sort | Kupče, Ēriks |
collection | PubMed |
description | [Image: see text] The principles employed in parallel NMR and MRI are applied to NMR supersequences yielding as many as ten 2D NMR spectra in one measurement. We present a number of examples where two NOAH (NMR by Ordered Acquisition using (1)H-detection) supersequences are recorded in parallel, thus dramatically increasing the information content obtained in a single NMR experiment. The two parallel supersequences entangled by time-sharing schemes (IPAP-seHSQC, HSQC-COSY, and HSQC-TOCSY) incorporate also modified (sequential and/or interleaved) conventional pulse schemes (modules), including HMBC, TOCSY, COSY, CLIP-COSY, NOESY, and ROESY. Such parallel supersequences can be tailored for specific applications, for instance, the analysis and characterization of molecular structure of complex organic molecules from a single measurement. In particular, the CASPER software was used to establish the structure of a tetrasaccharide, β-LNnTOMe, with a high degree of confidence from a single measurement involving a parallel NOAH-5 supersequence. |
format | Online Article Text |
id | pubmed-8611666 |
institution | National Center for Biotechnology Information |
language | English |
publishDate | 2021 |
publisher | American Chemical Society |
record_format | MEDLINE/PubMed |
spelling | pubmed-86116662021-11-26 Parallel NMR Supersequences: Ten Spectra in a Single Measurement Kupče, Ēriks Yong, Jonathan R. J. Widmalm, Göran Claridge, Tim D. W. JACS Au [Image: see text] The principles employed in parallel NMR and MRI are applied to NMR supersequences yielding as many as ten 2D NMR spectra in one measurement. We present a number of examples where two NOAH (NMR by Ordered Acquisition using (1)H-detection) supersequences are recorded in parallel, thus dramatically increasing the information content obtained in a single NMR experiment. The two parallel supersequences entangled by time-sharing schemes (IPAP-seHSQC, HSQC-COSY, and HSQC-TOCSY) incorporate also modified (sequential and/or interleaved) conventional pulse schemes (modules), including HMBC, TOCSY, COSY, CLIP-COSY, NOESY, and ROESY. Such parallel supersequences can be tailored for specific applications, for instance, the analysis and characterization of molecular structure of complex organic molecules from a single measurement. In particular, the CASPER software was used to establish the structure of a tetrasaccharide, β-LNnTOMe, with a high degree of confidence from a single measurement involving a parallel NOAH-5 supersequence. American Chemical Society 2021-11-09 /pmc/articles/PMC8611666/ /pubmed/34841408 http://dx.doi.org/10.1021/jacsau.1c00423 Text en © 2021 The Authors. Published by American Chemical Society https://creativecommons.org/licenses/by-nc-nd/4.0/Permits non-commercial access and re-use, provided that author attribution and integrity are maintained; but does not permit creation of adaptations or other derivative works (https://creativecommons.org/licenses/by-nc-nd/4.0/). |
spellingShingle | Kupče, Ēriks Yong, Jonathan R. J. Widmalm, Göran Claridge, Tim D. W. Parallel NMR Supersequences: Ten Spectra in a Single Measurement |
title | Parallel NMR Supersequences: Ten Spectra in a Single
Measurement |
title_full | Parallel NMR Supersequences: Ten Spectra in a Single
Measurement |
title_fullStr | Parallel NMR Supersequences: Ten Spectra in a Single
Measurement |
title_full_unstemmed | Parallel NMR Supersequences: Ten Spectra in a Single
Measurement |
title_short | Parallel NMR Supersequences: Ten Spectra in a Single
Measurement |
title_sort | parallel nmr supersequences: ten spectra in a single
measurement |
url | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8611666/ https://www.ncbi.nlm.nih.gov/pubmed/34841408 http://dx.doi.org/10.1021/jacsau.1c00423 |
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