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2dty

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(New page: 200px<br /><applet load="2dty" size="450" color="white" frame="true" align="right" spinBox="true" caption="2dty, resolution 2.65&Aring;" /> '''Crystal structure of...)
Current revision (08:30, 25 October 2023) (edit) (undo)
 
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[[Image:2dty.gif|left|200px]]<br /><applet load="2dty" size="450" color="white" frame="true" align="right" spinBox="true"
 
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caption="2dty, resolution 2.65&Aring;" />
 
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'''Crystal structure of basic winged bean lectin complexed with N-acetyl-D-galactosamine'''<br />
 
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==Overview==
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==Crystal structure of basic winged bean lectin complexed with N-acetyl-D-galactosamine==
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The crystal structure of the complexes of basic winged-bean lectin with, galactose, 2-methoxygalactose, N-acetylgalactosamine and, methyl-alpha-N-acetylgalactosamine have been determined. Lectin-sugar, interactions involve four hydrogen bonds and a stacking interaction in all, of the complexes. In addition, an N-H...O hydrogen bond involving the, hydroxyl group at C2 exists in the galactose and 2-methoxygalactose, complexes. An additional hydrophobic interaction involving the methyl, group in the latter leads to the higher affinity of the methyl derivative., In the lectin-N-acetylgalactosamine complex the N-H...O hydrogen bond is, lost, but a compensatory hydrogen bond is formed involving the O atom of, the acetamido group. In addition, the CH(3) moiety of the acetamido group, is involved in hydrophobic interactions. Consequently, the 2-methyl and, acetamido derivatives of galactose have nearly the same affinity for the, lectin. The methyl group alpha-linked to the galactose takes part in, additional hydrophobic interactions. Therefore, methyl-alpha-N-acetylgalactosamine has a higher affinity than, N-acetylgalactosamine for the lectin. The structures of basic winged-bean, lectin-sugar complexes provide a framework for examining the relative, affinity of galactose and galactosamine for the lectins that bind to them., The complexes also lead to a structural explanation for the blood-group, specificity of basic winged-bean lectin.
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<StructureSection load='2dty' size='340' side='right'caption='[[2dty]], [[Resolution|resolution]] 2.65&Aring;' scene=''>
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== Structural highlights ==
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<table><tr><td colspan='2'>[[2dty]] is a 4 chain structure with sequence from [https://en.wikipedia.org/wiki/Psophocarpus_tetragonolobus Psophocarpus tetragonolobus]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=2DTY OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=2DTY FirstGlance]. <br>
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</td></tr><tr id='method'><td class="sblockLbl"><b>[[Empirical_models|Method:]]</b></td><td class="sblockDat" id="methodDat">X-ray diffraction, [[Resolution|Resolution]] 2.65&#8491;</td></tr>
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<tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=A2G:N-ACETYL-2-DEOXY-2-AMINO-GALACTOSE'>A2G</scene>, <scene name='pdbligand=BMA:BETA-D-MANNOSE'>BMA</scene>, <scene name='pdbligand=CA:CALCIUM+ION'>CA</scene>, <scene name='pdbligand=FUC:ALPHA-L-FUCOSE'>FUC</scene>, <scene name='pdbligand=FUL:BETA-L-FUCOSE'>FUL</scene>, <scene name='pdbligand=MN:MANGANESE+(II)+ION'>MN</scene>, <scene name='pdbligand=NAG:N-ACETYL-D-GLUCOSAMINE'>NAG</scene></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=2dty FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=2dty OCA], [https://pdbe.org/2dty PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=2dty RCSB], [https://www.ebi.ac.uk/pdbsum/2dty PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=2dty ProSAT]</span></td></tr>
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</table>
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== Function ==
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[https://www.uniprot.org/uniprot/LEC1_PSOTE LEC1_PSOTE] Lectin.
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== Evolutionary Conservation ==
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[[Image:Consurf_key_small.gif|200px|right]]
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Check<jmol>
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<jmolCheckbox>
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<scriptWhenChecked>; select protein; define ~consurf_to_do selected; consurf_initial_scene = true; script "/wiki/ConSurf/dt/2dty_consurf.spt"</scriptWhenChecked>
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<scriptWhenUnchecked>script /wiki/extensions/Proteopedia/spt/initialview01.spt</scriptWhenUnchecked>
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<text>to colour the structure by Evolutionary Conservation</text>
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</jmolCheckbox>
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</jmol>, as determined by [http://consurfdb.tau.ac.il/ ConSurfDB]. You may read the [[Conservation%2C_Evolutionary|explanation]] of the method and the full data available from [http://bental.tau.ac.il/new_ConSurfDB/main_output.php?pdb_ID=2dty ConSurf].
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<div style="clear:both"></div>
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<div style="background-color:#fffaf0;">
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== Publication Abstract from PubMed ==
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The crystal structure of the complexes of basic winged-bean lectin with galactose, 2-methoxygalactose, N-acetylgalactosamine and methyl-alpha-N-acetylgalactosamine have been determined. Lectin-sugar interactions involve four hydrogen bonds and a stacking interaction in all of the complexes. In addition, an N-H...O hydrogen bond involving the hydroxyl group at C2 exists in the galactose and 2-methoxygalactose complexes. An additional hydrophobic interaction involving the methyl group in the latter leads to the higher affinity of the methyl derivative. In the lectin-N-acetylgalactosamine complex the N-H...O hydrogen bond is lost, but a compensatory hydrogen bond is formed involving the O atom of the acetamido group. In addition, the CH(3) moiety of the acetamido group is involved in hydrophobic interactions. Consequently, the 2-methyl and acetamido derivatives of galactose have nearly the same affinity for the lectin. The methyl group alpha-linked to the galactose takes part in additional hydrophobic interactions. Therefore, methyl-alpha-N-acetylgalactosamine has a higher affinity than N-acetylgalactosamine for the lectin. The structures of basic winged-bean lectin-sugar complexes provide a framework for examining the relative affinity of galactose and galactosamine for the lectins that bind to them. The complexes also lead to a structural explanation for the blood-group specificity of basic winged-bean lectin.
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==About this Structure==
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Structural basis for the carbohydrate-specificity of basic winged-bean lectin and its differential affinity for Gal and GalNAc.,Kulkarni KA, Katiyar S, Surolia A, Vijayan M, Suguna K Acta Crystallogr D Biol Crystallogr. 2006 Nov;62(Pt 11):1319-24. Epub 2006, Oct 18. PMID:17057334<ref>PMID:17057334</ref>
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2DTY is a [http://en.wikipedia.org/wiki/Single_protein Single protein] structure of sequence from [http://en.wikipedia.org/wiki/Psophocarpus_tetragonolobus Psophocarpus tetragonolobus] with A2G, MN and CA as [http://en.wikipedia.org/wiki/ligands ligands]. Full crystallographic information is available from [http://ispc.weizmann.ac.il/oca-bin/ocashort?id=2DTY 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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Structural basis for the carbohydrate-specificity of basic winged-bean lectin and its differential affinity for Gal and GalNAc., Kulkarni KA, Katiyar S, Surolia A, Vijayan M, Suguna K, Acta Crystallogr D Biol Crystallogr. 2006 Nov;62(Pt 11):1319-24. Epub 2006, Oct 18. PMID:[http://ispc.weizmann.ac.il//pmbin/getpm?pmid=17057334 17057334]
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</div>
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[[Category: Psophocarpus tetragonolobus]]
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<div class="pdbe-citations 2dty" style="background-color:#fffaf0;"></div>
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[[Category: Single protein]]
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[[Category: Katiyar, S.]]
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[[Category: Kulkarni, K.A.]]
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[[Category: Suguna, K.]]
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[[Category: Surolia, A.]]
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[[Category: Vijayan, M.]]
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[[Category: A2G]]
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[[Category: CA]]
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[[Category: MN]]
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[[Category: agglutinin]]
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[[Category: glycosylated protein]]
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[[Category: legume lectin]]
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''Page seeded by [http://ispc.weizmann.ac.il/oca OCA ] on Wed Nov 21 09:46:48 2007''
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==See Also==
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*[[Agglutinin 3D structures|Agglutinin 3D structures]]
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== References ==
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<references/>
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__TOC__
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</StructureSection>
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[[Category: Large Structures]]
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[[Category: Psophocarpus tetragonolobus]]
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[[Category: Katiyar S]]
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[[Category: Kulkarni KA]]
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[[Category: Suguna K]]
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[[Category: Surolia A]]
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[[Category: Vijayan M]]

Current revision

Crystal structure of basic winged bean lectin complexed with N-acetyl-D-galactosamine

PDB ID 2dty

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