Structure determination of noncanonical RNA motifs guided by 1 H NMR chemical shifts

Structured noncoding RNAs underlie fundamental cellular processes, but determining their three-dimensional structures remains challenging. We demonstrate that integrating 1H NMR chemical shift data with Rosetta de novo modeling can be used to consistently determine high-resolution RNA structures. On...

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Main Authors: Sripakdeevong, P, Cevec, M, Chang, A, Erat, M, Ziegeler, M, Zhao, Q, Fox, G, Gao, X, Kennedy, S, Kierzek, R, Nikonowicz, E, Schwalbe, H, Sigel, R, Turner, D, Das, R
Formato: Journal article
Idioma:English
Publicado em: Nature Publishing Group 2014
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author Sripakdeevong, P
Cevec, M
Chang, A
Erat, M
Ziegeler, M
Zhao, Q
Fox, G
Gao, X
Kennedy, S
Kierzek, R
Nikonowicz, E
Schwalbe, H
Sigel, R
Turner, D
Das, R
author_facet Sripakdeevong, P
Cevec, M
Chang, A
Erat, M
Ziegeler, M
Zhao, Q
Fox, G
Gao, X
Kennedy, S
Kierzek, R
Nikonowicz, E
Schwalbe, H
Sigel, R
Turner, D
Das, R
author_sort Sripakdeevong, P
collection OXFORD
description Structured noncoding RNAs underlie fundamental cellular processes, but determining their three-dimensional structures remains challenging. We demonstrate that integrating 1H NMR chemical shift data with Rosetta de novo modeling can be used to consistently determine high-resolution RNA structures. On a benchmark set of 23 noncanonical RNA motifs, including 11 'blind' targets, chemical-shift Rosetta for RNA (CS-Rosetta-RNA) recovered experimental structures with high accuracy (0.6-2.0 Å all-heavy-atom r.m.s. deviation) in 18 cases. © 2014 Nature America, Inc. All rights reserved.
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spelling oxford-uuid:06919519-9954-4040-8d3d-50419bc6aeb62022-03-26T09:03:14ZStructure determination of noncanonical RNA motifs guided by 1 H NMR chemical shiftsJournal articlehttp://purl.org/coar/resource_type/c_dcae04bcuuid:06919519-9954-4040-8d3d-50419bc6aeb6EnglishSymplectic Elements at OxfordNature Publishing Group2014Sripakdeevong, PCevec, MChang, AErat, MZiegeler, MZhao, QFox, GGao, XKennedy, SKierzek, RNikonowicz, ESchwalbe, HSigel, RTurner, DDas, RStructured noncoding RNAs underlie fundamental cellular processes, but determining their three-dimensional structures remains challenging. We demonstrate that integrating 1H NMR chemical shift data with Rosetta de novo modeling can be used to consistently determine high-resolution RNA structures. On a benchmark set of 23 noncanonical RNA motifs, including 11 'blind' targets, chemical-shift Rosetta for RNA (CS-Rosetta-RNA) recovered experimental structures with high accuracy (0.6-2.0 Å all-heavy-atom r.m.s. deviation) in 18 cases. © 2014 Nature America, Inc. All rights reserved.
spellingShingle Sripakdeevong, P
Cevec, M
Chang, A
Erat, M
Ziegeler, M
Zhao, Q
Fox, G
Gao, X
Kennedy, S
Kierzek, R
Nikonowicz, E
Schwalbe, H
Sigel, R
Turner, D
Das, R
Structure determination of noncanonical RNA motifs guided by 1 H NMR chemical shifts
title Structure determination of noncanonical RNA motifs guided by 1 H NMR chemical shifts
title_full Structure determination of noncanonical RNA motifs guided by 1 H NMR chemical shifts
title_fullStr Structure determination of noncanonical RNA motifs guided by 1 H NMR chemical shifts
title_full_unstemmed Structure determination of noncanonical RNA motifs guided by 1 H NMR chemical shifts
title_short Structure determination of noncanonical RNA motifs guided by 1 H NMR chemical shifts
title_sort structure determination of noncanonical rna motifs guided by 1 h nmr chemical shifts
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