6l2e

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'''Unreleased structure'''
 
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The entry 6l2e is ON HOLD until Paper Publication
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==Crystal structure of a cupin protein (tm1459, H52A mutant) in copper (Cu) substituted form==
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<StructureSection load='6l2e' size='340' side='right'caption='[[6l2e]], [[Resolution|resolution]] 1.20&Aring;' scene=''>
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== Structural highlights ==
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<table><tr><td colspan='2'>[[6l2e]] is a 2 chain structure. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=6L2E OCA]. For a <b>guided tour on the structure components</b> use [http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=6L2E FirstGlance]. <br>
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</td></tr><tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat"><scene name='pdbligand=CU:COPPER+(II)+ION'>CU</scene>, <scene name='pdbligand=MES:2-(N-MORPHOLINO)-ETHANESULFONIC+ACID'>MES</scene></td></tr>
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<tr id='NonStdRes'><td class="sblockLbl"><b>[[Non-Standard_Residue|NonStd Res:]]</b></td><td class="sblockDat"><scene name='pdbligand=CSD:3-SULFINOALANINE'>CSD</scene></td></tr>
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<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[http://oca.weizmann.ac.il/oca-docs/fgij/fg.htm?mol=6l2e FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=6l2e OCA], [http://pdbe.org/6l2e PDBe], [http://www.rcsb.org/pdb/explore.do?structureId=6l2e RCSB], [http://www.ebi.ac.uk/pdbsum/6l2e PDBsum], [http://prosat.h-its.org/prosat/prosatexe?pdbcode=6l2e ProSAT]</span></td></tr>
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</table>
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<div style="background-color:#fffaf0;">
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== Publication Abstract from PubMed ==
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Cupin superfamily proteins (TM1459) work as a macromolecular ligand framework with a double-stranded beta-barrel structure ligating to a Cu ion through histidine side chains. Variegating the first coordination sphere of TM1459 revealed that H52A and H54A/H58A mutants effectively catalyzed the diastereo- and enantioselective Michael addition reaction of nitroalkanes to an alpha,beta-unsaturated ketone. Moreover, calculated substrate docking signified C106N and F104W single-point mutations, which inverted the diastereoselectivity of H52A and further improved the stereoselectivity of H54A/H58A, respectively.
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Authors: Fujieda, N., Ichihashi, H., Nishikawa, Y., Kurisu, G., Itoh, S.
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Cupin Variants as a Macromolecular Ligand Library for Stereoselective Michael Addition of Nitroalkanes.,Fujieda N, Ichihashi H, Yuasa M, Nishikawa Y, Kurisu G, Itoh S Angew Chem Int Ed Engl. 2020 Feb 19. doi: 10.1002/anie.202000129. PMID:32073197<ref>PMID:32073197</ref>
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Description: Crystal structure of a cupin protein (tm1459, H52A mutant) in copper (Cu) substituted form
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From MEDLINE&reg;/PubMed&reg;, a database of the U.S. National Library of Medicine.<br>
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[[Category: Unreleased Structures]]
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</div>
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<div class="pdbe-citations 6l2e" style="background-color:#fffaf0;"></div>
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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: Fujieda, N]]
[[Category: Ichihashi, H]]
[[Category: Ichihashi, H]]
[[Category: Itoh, S]]
[[Category: Itoh, S]]
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[[Category: Nishikawa, Y]]
 
[[Category: Kurisu, G]]
[[Category: Kurisu, G]]
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[[Category: Fujieda, N]]
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[[Category: Nishikawa, Y]]
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[[Category: Artificial metalloenzyme]]
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[[Category: Copper enzyme]]
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[[Category: Cupin]]
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[[Category: Metal binding protein]]

Revision as of 09:08, 1 April 2020

Crystal structure of a cupin protein (tm1459, H52A mutant) in copper (Cu) substituted form

PDB ID 6l2e

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