9xsa: Difference between revisions

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'''Unreleased structure'''


The entry 9xsa is ON HOLD  until Paper Publication
==Crystal structure of a cupin protein (tm1459, R39M/H52A/H54A/H92A/C106E mutant) in ruthenium(p-cymene) bound form==
<StructureSection load='9xsa' size='340' side='right'caption='[[9xsa]], [[Resolution|resolution]] 1.42&Aring;' scene=''>
== Structural highlights ==
<table><tr><td colspan='2'>[[9xsa]] is a 2 chain structure with sequence from [https://en.wikipedia.org/wiki/Thermotoga_maritima_MSB8 Thermotoga maritima MSB8]. Full crystallographic information is available from [http://oca.weizmann.ac.il/oca-bin/ocashort?id=9XSA OCA]. For a <b>guided tour on the structure components</b> use [https://proteopedia.org/fgij/fg.htm?mol=9XSA FirstGlance]. <br>
</td></tr><tr id='method'><td class="sblockLbl"><b>[[Empirical_models|Method:]]</b></td><td class="sblockDat" id="methodDat">X-ray diffraction, [[Resolution|Resolution]] 1.423&#8491;</td></tr>
<tr id='ligand'><td class="sblockLbl"><b>[[Ligand|Ligands:]]</b></td><td class="sblockDat" id="ligandDat"><scene name='pdbligand=MML:1-METHYL-4-(1-METHYLETHYL)BENZENE'>MML</scene>, <scene name='pdbligand=RU:RUTHENIUM+ION'>RU</scene></td></tr>
<tr id='resources'><td class="sblockLbl"><b>Resources:</b></td><td class="sblockDat"><span class='plainlinks'>[https://proteopedia.org/fgij/fg.htm?mol=9xsa FirstGlance], [http://oca.weizmann.ac.il/oca-bin/ocaids?id=9xsa OCA], [https://pdbe.org/9xsa PDBe], [https://www.rcsb.org/pdb/explore.do?structureId=9xsa RCSB], [https://www.ebi.ac.uk/pdbsum/9xsa PDBsum], [https://prosat.h-its.org/prosat/prosatexe?pdbcode=9xsa ProSAT]</span></td></tr>
</table>
== Function ==
[https://www.uniprot.org/uniprot/Q9X1H0_THEMA Q9X1H0_THEMA]
<div style="background-color:#fffaf0;">
== Publication Abstract from PubMed ==
A ruthenium(p-cymene)-cupin complex functioning as an artificial ketone reductase was developed through structure-guided engineering. Refinement of the primary and secondary coordination spheres based on a 1-His metal-binding motif enabled efficient asymmetric transfer hydrogenation of trifluoroacetophenone in water, affording up to 95% ee and 92% coupling efficiency.


Authors:  
Rational design of a ruthenium-cupin complex as an artificial ketone reductase.,Matsumoto K, Kitazawa S, Matsumoto R, Morita Y, Fujieda N Chem Commun (Camb). 2026 Mar 17;62(21):5942-5946. doi: 10.1039/d5cc07188g. PMID:41769794<ref>PMID:41769794</ref>


Description:  
From MEDLINE&reg;/PubMed&reg;, a database of the U.S. National Library of Medicine.<br>
[[Category: Unreleased Structures]]
</div>
<div class="pdbe-citations 9xsa" style="background-color:#fffaf0;"></div>
== References ==
<references/>
__TOC__
</StructureSection>
[[Category: Large Structures]]
[[Category: Thermotoga maritima MSB8]]
[[Category: Fujieda N]]
[[Category: Matsumoto K]]
[[Category: Matsumoto R]]
[[Category: Morita Y]]

Latest revision as of 08:32, 29 April 2026

Crystal structure of a cupin protein (tm1459, R39M/H52A/H54A/H92A/C106E mutant) in ruthenium(p-cymene) bound form

9xsa, resolution 1.42Å

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