1bwt

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(New page: 200px<br /><applet load="1bwt" size="450" color="white" frame="true" align="right" spinBox="true" caption="1bwt" /> '''NMR SOLUTION STRUCTURE OF [D(GCGAATCGC)2]'''...)
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'''NMR SOLUTION STRUCTURE OF [D(GCGAATCGC)2]'''<br />
'''NMR SOLUTION STRUCTURE OF [D(GCGAATCGC)2]'''<br />
==Overview==
==Overview==
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We present the high-resolution solution structures of a self-complementary, DNA decamer duplex featuring a single alpha-anomeric nucleotide per strand, encompassed by a set of 3'-3' and 5'-5' phosphodiester linkages, d(GCGAAT-3'-3'-alphaT-5'-5'-CGC)2, alphaT, and its unmodified control, d(GCGAATTCGC)2, obtained by restrained molecular dynamics. Interproton, distance and deoxyribose ring torsion angle restraints were deduced from, homonuclear NOESY and DQF-COSY data, respectively. For both the control, and alphaT duplexes, excellent global convergence was observed from two, different (A- and B-) starting models. The final average structures of the, two duplexes are highly homologous, and overall possess the traits, characteristic of right-handed B-DNA duplexes. However, localized, differences between the two structures stem from the enhanced, conformational exchange in the deoxyribose ring of the cytidine following, the 5'-5' linkage, the C3'- exo pseudorotation phase angle of the, alpha-nucleotide, and unusual backbone torsions in the 3'-3' and 5'-5', phosphodiester linkages. The structural data reported here are relevant to, the design of antisense therapeutics comprised of these modifications.
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We present the high-resolution solution structures of a self-complementary DNA decamer duplex featuring a single alpha-anomeric nucleotide per strand encompassed by a set of 3'-3' and 5'-5' phosphodiester linkages, d(GCGAAT-3'-3'-alphaT-5'-5'-CGC)2, alphaT, and its unmodified control, d(GCGAATTCGC)2, obtained by restrained molecular dynamics. Interproton distance and deoxyribose ring torsion angle restraints were deduced from homonuclear NOESY and DQF-COSY data, respectively. For both the control and alphaT duplexes, excellent global convergence was observed from two different (A- and B-) starting models. The final average structures of the two duplexes are highly homologous, and overall possess the traits characteristic of right-handed B-DNA duplexes. However, localized differences between the two structures stem from the enhanced conformational exchange in the deoxyribose ring of the cytidine following the 5'-5' linkage, the C3'- exo pseudorotation phase angle of the alpha-nucleotide, and unusual backbone torsions in the 3'-3' and 5'-5' phosphodiester linkages. The structural data reported here are relevant to the design of antisense therapeutics comprised of these modifications.
==About this Structure==
==About this Structure==
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1BWT is a [http://en.wikipedia.org/wiki/Protein_complex Protein complex] structure of sequences from [http://en.wikipedia.org/wiki/ ]. Full crystallographic information is available from [http://ispc.weizmann.ac.il/oca-bin/ocashort?id=1BWT OCA].
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1BWT is a [http://en.wikipedia.org/wiki/Protein_complex Protein complex] structure of sequences from [http://en.wikipedia.org/wiki/ ]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=1BWT OCA].
==Reference==
==Reference==
NMR solution structures of [d(GCGAAT-3'-3'-alphaT-5'-5'-CGC)2] and its unmodified control., Aramini JM, Mujeeb A, Germann MW, Nucleic Acids Res. 1998 Dec 15;26(24):5644-54. PMID:[http://ispc.weizmann.ac.il//pmbin/getpm?pmid=9837995 9837995]
NMR solution structures of [d(GCGAAT-3'-3'-alphaT-5'-5'-CGC)2] and its unmodified control., Aramini JM, Mujeeb A, Germann MW, Nucleic Acids Res. 1998 Dec 15;26(24):5644-54. PMID:[http://ispc.weizmann.ac.il//pmbin/getpm?pmid=9837995 9837995]
[[Category: Protein complex]]
[[Category: Protein complex]]
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[[Category: Aramini, J.M.]]
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[[Category: Aramini, J M.]]
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[[Category: Germann, M.W.]]
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[[Category: Germann, M W.]]
[[Category: Mujeeb, A.]]
[[Category: Mujeeb, A.]]
[[Category: ecori recognition site]]
[[Category: ecori recognition site]]
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''Page seeded by [http://ispc.weizmann.ac.il/oca OCA ] on Sun Nov 25 00:43:11 2007''
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Thu Feb 21 11:59:56 2008''

Revision as of 09:59, 21 February 2008


1bwt

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NMR SOLUTION STRUCTURE OF [D(GCGAATCGC)2]

Overview

We present the high-resolution solution structures of a self-complementary DNA decamer duplex featuring a single alpha-anomeric nucleotide per strand encompassed by a set of 3'-3' and 5'-5' phosphodiester linkages, d(GCGAAT-3'-3'-alphaT-5'-5'-CGC)2, alphaT, and its unmodified control, d(GCGAATTCGC)2, obtained by restrained molecular dynamics. Interproton distance and deoxyribose ring torsion angle restraints were deduced from homonuclear NOESY and DQF-COSY data, respectively. For both the control and alphaT duplexes, excellent global convergence was observed from two different (A- and B-) starting models. The final average structures of the two duplexes are highly homologous, and overall possess the traits characteristic of right-handed B-DNA duplexes. However, localized differences between the two structures stem from the enhanced conformational exchange in the deoxyribose ring of the cytidine following the 5'-5' linkage, the C3'- exo pseudorotation phase angle of the alpha-nucleotide, and unusual backbone torsions in the 3'-3' and 5'-5' phosphodiester linkages. The structural data reported here are relevant to the design of antisense therapeutics comprised of these modifications.

About this Structure

1BWT is a Protein complex structure of sequences from [1]. Full crystallographic information is available from OCA.

Reference

NMR solution structures of [d(GCGAAT-3'-3'-alphaT-5'-5'-CGC)2] and its unmodified control., Aramini JM, Mujeeb A, Germann MW, Nucleic Acids Res. 1998 Dec 15;26(24):5644-54. PMID:9837995

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