1ekd

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[[Image:1ekd.gif|left|200px]]
 
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==NMR AND MOLECULAR MODELING REVEAL THAT DIFFERENT HYDROGEN BONDING PATTERNS ARE POSSIBLE FOR GU PAIRS: ONE HYDROGEN BOND FOR EACH GU PAIR IN R(GGCGUGCC)2 AND TWO FOR EACH GU PAIR IN R(GAGUGCUC)2==
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The line below this paragraph, containing "STRUCTURE_1ekd", creates the "Structure Box" on the page.
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<StructureSection load='1ekd' size='340' side='right'caption='[[1ekd]]' scene=''>
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You may change the PDB parameter (which sets the PDB file loaded into the applet)
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== Structural highlights ==
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or the SCENE parameter (which sets the initial scene displayed when the page is loaded),
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<table><tr><td colspan='2'>[[1ekd]] is a 2 chain structure. Full experimental information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=1EKD OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=1EKD FirstGlance]. <br>
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or leave the SCENE parameter empty for the default display.
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</td></tr><tr id='method'><td class="sblockLbl"><b>[[Empirical_models|Method:]]</b></td><td class="sblockDat" id="methodDat">Solution NMR</td></tr>
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<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[https://proteopedia.org/fgij/fg.htm?mol=1ekd FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=1ekd OCA], [https://pdbe.org/1ekd PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=1ekd RCSB], [https://www.ebi.ac.uk/pdbsum/1ekd PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=1ekd ProSAT]</span></td></tr>
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{{STRUCTURE_1ekd| PDB=1ekd | SCENE= }}
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</table>
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<div style="background-color:#fffaf0;">
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'''NMR AND MOLECULAR MODELING REVEAL THAT DIFFERENT HYDROGEN BONDING PATTERNS ARE POSSIBLE FOR GU PAIRS: ONE HYDROGEN BOND FOR EACH GU PAIR IN R(GGCGUGCC)2 AND TWO FOR EACH GU PAIR IN R(GAGUGCUC)2'''
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== Publication Abstract from PubMed ==
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==Overview==
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G.U pairs occur frequently and have many important biological functions. The stability of symmetric tandem G.U motifs depends both on the adjacent Watson-Crick base pairs, e.g., 5'G &gt; 5'C, and the sequence of the G.U pairs, i.e., 5'-UG-3' &gt; 5'-GU-3', where an underline represents a nucleotide in a G.U pair [Wu, M., McDowell, J. A., and Turner, D. H. (1995) Biochemistry 34, 3204-3211]. In particular, at 37 degrees C, the motif 5'-CGUG-3' is less stable by approximately 3 kcal/mol compared with other symmetric tandem G.U motifs with G-C as adjacent pairs: 5'-GGUC-3', 5'-GUGC-3', and 5'-CUGG-3'. The solution structures of r(GAGUGCUC)(2) and r(GGCGUGCC)(2) duplexes have been determined by NMR and restrained simulated annealing. The global geometry of both duplexes is close to A-form, with some distortions localized in the tandem G.U pair region. The striking discovery is that in r(GGCGUGCC)(2) each G.U pair apparently has only one hydrogen bond instead of the two expected for a canonical wobble pair. In the one-hydrogen-bond model, the distance between GO6 and UH3 is too far to form a hydrogen bond. In addition, the temperature dependence of the imino proton resonances is also consistent with the different number of hydrogen bonds in the G.U pair. To test the NMR models, U or G in various G.U pairs were individually replaced by N3-methyluridine or isoguanosine, respectively, thus eliminating the possibility of hydrogen bonding between GO6 and UH3. The results of thermal melting studies on duplexes with these substitutions support the NMR models.
G.U pairs occur frequently and have many important biological functions. The stability of symmetric tandem G.U motifs depends both on the adjacent Watson-Crick base pairs, e.g., 5'G &gt; 5'C, and the sequence of the G.U pairs, i.e., 5'-UG-3' &gt; 5'-GU-3', where an underline represents a nucleotide in a G.U pair [Wu, M., McDowell, J. A., and Turner, D. H. (1995) Biochemistry 34, 3204-3211]. In particular, at 37 degrees C, the motif 5'-CGUG-3' is less stable by approximately 3 kcal/mol compared with other symmetric tandem G.U motifs with G-C as adjacent pairs: 5'-GGUC-3', 5'-GUGC-3', and 5'-CUGG-3'. The solution structures of r(GAGUGCUC)(2) and r(GGCGUGCC)(2) duplexes have been determined by NMR and restrained simulated annealing. The global geometry of both duplexes is close to A-form, with some distortions localized in the tandem G.U pair region. The striking discovery is that in r(GGCGUGCC)(2) each G.U pair apparently has only one hydrogen bond instead of the two expected for a canonical wobble pair. In the one-hydrogen-bond model, the distance between GO6 and UH3 is too far to form a hydrogen bond. In addition, the temperature dependence of the imino proton resonances is also consistent with the different number of hydrogen bonds in the G.U pair. To test the NMR models, U or G in various G.U pairs were individually replaced by N3-methyluridine or isoguanosine, respectively, thus eliminating the possibility of hydrogen bonding between GO6 and UH3. The results of thermal melting studies on duplexes with these substitutions support the NMR models.
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==About this Structure==
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Nuclear magnetic resonance spectroscopy and molecular modeling reveal that different hydrogen bonding patterns are possible for G.U pairs: one hydrogen bond for each G.U pair in r(GGCGUGCC)(2) and two for each G.U pair in r(GAGUGCUC)(2).,Chen X, McDowell JA, Kierzek R, Krugh TR, Turner DH Biochemistry. 2000 Aug 1;39(30):8970-82. PMID:10913310<ref>PMID:10913310</ref>
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Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=1EKD OCA].
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==Reference==
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From MEDLINE&reg;/PubMed&reg;, a database of the U.S. National Library of Medicine.<br>
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Nuclear magnetic resonance spectroscopy and molecular modeling reveal that different hydrogen bonding patterns are possible for G.U pairs: one hydrogen bond for each G.U pair in r(GGCGUGCC)(2) and two for each G.U pair in r(GAGUGCUC)(2)., Chen X, McDowell JA, Kierzek R, Krugh TR, Turner DH, Biochemistry. 2000 Aug 1;39(30):8970-82. PMID:[http://www.ncbi.nlm.nih.gov/pubmed/10913310 10913310]
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</div>
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[[Category: Chen, X.]]
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<div class="pdbe-citations 1ekd" style="background-color:#fffaf0;"></div>
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[[Category: Kierzek, R.]]
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== References ==
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[[Category: Krugh, T R.]]
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<references/>
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[[Category: McDowell, J A.]]
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__TOC__
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[[Category: Turner, D H.]]
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</StructureSection>
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[[Category: Double helix]]
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[[Category: Large Structures]]
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[[Category: Gu pair]]
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[[Category: Chen X]]
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[[Category: Hydrogen bond]]
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[[Category: Kierzek R]]
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[[Category: Rna]]
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[[Category: Krugh TR]]
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''Page seeded by [http://oca.weizmann.ac.il/oca OCA ] on Fri May 2 15:12:27 2008''
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[[Category: McDowell JA]]
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[[Category: Turner DH]]

Current revision

NMR AND MOLECULAR MODELING REVEAL THAT DIFFERENT HYDROGEN BONDING PATTERNS ARE POSSIBLE FOR GU PAIRS: ONE HYDROGEN BOND FOR EACH GU PAIR IN R(GGCGUGCC)2 AND TWO FOR EACH GU PAIR IN R(GAGUGCUC)2

PDB ID 1ekd

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