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| [[Image:1yrm.gif|left|200px]]<br /><applet load="1yrm" size="450" color="white" frame="true" align="right" spinBox="true"
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| caption="1yrm, resolution 2.50Å" />
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| '''Crystal Structure of an RNA duplex containing site specific 2'-amine substitutions at a C-A mismatch'''<br />
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| ==Overview== | | ==Crystal Structure of an RNA duplex containing site specific 2'-amine substitutions at a C-A mismatch== |
| Ribose 2'-amine substitutions are broadly useful as structural probes in, nucleic acids. In addition, structure-selective chemical reaction at, 2'-amine groups is a robust technology for interrogating local nucleotide, flexibility and conformational changes in RNA and DNA. We analyzed crystal, structures for several RNA duplexes containing 2'-amino cytidine (C(N)), residues that form either C(N)-G base pairs or C(N)-A mismatches. The, 2'-amine substitution is readily accommodated in an A-form RNA helix and, thus differs from the C2'-endo conformation observed for free nucleosides., The 2'-amide product structure was visualized directly by acylating a, C(N)-A mismatch in intact crystals and is also compatible with A-form, geometry. To visualize conformations able to facilitate formation of the, amide-forming transition state, in which the amine nucleophile carries a, positive partial charge, we analyzed crystals of the C(N)-A duplex at pH, 5, where the 2'-amine is protonated. The protonated amine moves to form a, strong electrostatic interaction with the 3'-phosphodiester. Taken, together with solution-phase experiments, 2'-amine acylation is likely, facilitated by either of two transition states, both involving precise, positioning of the adjacent 3'-phosphodiester group.
| | <StructureSection load='1yrm' size='340' side='right'caption='[[1yrm]], [[Resolution|resolution]] 2.50Å' scene=''> |
| | | == Structural highlights == |
| ==About this Structure== | | <table><tr><td colspan='2'>[[1yrm]] is a 3 chain structure. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=1YRM OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=1YRM FirstGlance]. <br> |
| 1YRM is a [http://en.wikipedia.org/wiki/Protein_complex Protein complex] structure of sequences from [http://en.wikipedia.org/wiki/ ] with SR as [http://en.wikipedia.org/wiki/ligand ligand]. Full crystallographic information is available from [http://ispc.weizmann.ac.il/oca-bin/ocashort?id=1YRM OCA].
| | </td></tr><tr id='method'><td class="sblockLbl"><b>[[Empirical_models|Method:]]</b></td><td class="sblockDat" id="methodDat">X-ray diffraction, [[Resolution|Resolution]] 2.5Å</td></tr> |
| | | <tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=A5M:2-AMINE-CYTIDINE-5-MONOPHOSPHATE'>A5M</scene>, <scene name='pdbligand=SR:STRONTIUM+ION'>SR</scene></td></tr> |
| ==Reference== | | <tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[https://proteopedia.org/fgij/fg.htm?mol=1yrm FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=1yrm OCA], [https://pdbe.org/1yrm PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=1yrm RCSB], [https://www.ebi.ac.uk/pdbsum/1yrm PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=1yrm ProSAT]</span></td></tr> |
| Crystal structures, reactivity and inferred acylation transition states for 2'-amine substituted RNA., Gherghe CM, Krahn JM, Weeks KM, J Am Chem Soc. 2005 Oct 5;127(39):13622-8. PMID:[http://ispc.weizmann.ac.il//pmbin/getpm?pmid=16190727 16190727]
| | </table> |
| [[Category: Protein complex]]
| | __TOC__ |
| [[Category: Gherghe, C.M.]] | | </StructureSection> |
| [[Category: Krahn, J.M.]]
| | [[Category: Large Structures]] |
| [[Category: Weeks, K.M.]]
| | [[Category: Gherghe CM]] |
| [[Category: SR]]
| | [[Category: Krahn JM]] |
| [[Category: 2'-amine]] | | [[Category: Weeks KM]] |
| [[Category: duplex]] | |
| [[Category: mismatch]] | |
| [[Category: rna]] | |
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| ''Page seeded by [http://ispc.weizmann.ac.il/oca OCA ] on Sun Nov 25 04:32:17 2007''
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