Structure determination of noncanonical RNA motifs guided by ¹H 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
Format: Journal article
Language:English
Published: 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.
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spelling oxford-uuid:a95a6b31-65f9-4e0b-89b5-e7de3b8c349e2022-03-27T03:07:58ZStructure determination of noncanonical RNA motifs guided by ¹H NMR chemical shifts.Journal articlehttp://purl.org/coar/resource_type/c_dcae04bcuuid:a95a6b31-65f9-4e0b-89b5-e7de3b8c349eEnglishSymplectic Elements at Oxford2014Sripakdeevong, 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.
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 ¹H NMR chemical shifts.
title Structure determination of noncanonical RNA motifs guided by ¹H NMR chemical shifts.
title_full Structure determination of noncanonical RNA motifs guided by ¹H NMR chemical shifts.
title_fullStr Structure determination of noncanonical RNA motifs guided by ¹H NMR chemical shifts.
title_full_unstemmed Structure determination of noncanonical RNA motifs guided by ¹H NMR chemical shifts.
title_short Structure determination of noncanonical RNA motifs guided by ¹H NMR chemical shifts.
title_sort structure determination of noncanonical rna motifs guided by ¹h nmr chemical shifts
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