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000617141 0247_ $$2ISSN$$a1943-2984
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000617141 1001_ $$0P:(DE-HGF)0$$aKwiatkowski, Anna$$b0$$eFirst author
000617141 245__ $$aATP-Triggered Fe(CN)$_2$CO Synthon Transfer from the Maturase HypCD to the Active Site of Apo-[NiFe]-Hydrogenase
000617141 260__ $$aWashington, DC$$bACS Publications$$c2024
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000617141 500__ $$aAdditional Funding: COSTAction FeSImmChemNet, CA21115, supported by COST(European Cooperation in Science and Technology). The Wellcome Centre for Cell Biology is supported by core fundingfrom the Wellcome Trust [203149] (J.R.).
000617141 520__ $$a[NiFe]-hydrogenases catalyze the reversible activation of H$_2$ using a unique NiFe(CN)2CO metal site, which is assembled by a sophisticated multiprotein machinery. The [4Fe–4S] cluster-containing HypCD complex, which possesses an ATPase activity with a hitherto unknown function, serves as the hub for the assembly of the Fe(CN)$_2$CO subfragment. HypCD is also thought to be responsible for the subsequent transfer of the iron fragment to the apo-form of the catalytic hydrogenase subunit, but the underlying mechanism has remained unexplored. Here, we performed a thorough spectroscopic characterization of different HypCD preparations using infrared, Mössbauer, and NRVS spectroscopy, revealing molecular details of the coordination of the Fe(CN)$_2$CO fragment. Moreover, biochemical assays in combination with spectroscopy, AlphaFold structure predictions, protein–ligand docking calculations, and crosslinking MS deciphered unexpected mechanistic aspects of the ATP requirement of HypCD, which we found to actually trigger the transfer of the Fe(CN)$_2$CO fragment to the apo-hydrogenase.
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000617141 536__ $$0G:(GEPRIS)449713269$$aDFG project G:(GEPRIS)449713269 - Design, Synthese und Analyse von photospaltbaren chemischen Crosslinkern zur Entwicklung von verbesserten Methoden in der Crosslinking Massenspektrometrie (449713269)$$c449713269$$x5
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000617141 7001_ $$0P:(DE-H253)PIP1092788$$aCaserta, Giorgio$$b1$$eCorresponding author
000617141 7001_ $$0P:(DE-HGF)0$$aSchulz, Anne-Christine$$b2
000617141 7001_ $$0P:(DE-HGF)0$$aFrielingsdorf, Stefan$$b3
000617141 7001_ $$0P:(DE-HGF)0$$aPelmenschikov, Vladimir$$b4
000617141 7001_ $$0P:(DE-HGF)0$$aWeisser, Kilian$$b5
000617141 7001_ $$0P:(DE-HGF)0$$aBelsom, Adam$$b6
000617141 7001_ $$0P:(DE-HGF)0$$aRappsilber, Juri$$b7
000617141 7001_ $$0P:(DE-H253)PIP1016663$$aSergueev, Ilya$$b8$$udesy
000617141 7001_ $$0P:(DE-HGF)0$$aLimberg, Christian$$b9
000617141 7001_ $$0P:(DE-HGF)0$$aMroginski, Maria-Andrea$$b10
000617141 7001_ $$0P:(DE-H253)PIP1100480$$aZebger, Ingo$$b11
000617141 7001_ $$0P:(DE-HGF)0$$aLenz, Oliver$$b12$$eCorresponding author
000617141 77318 $$2Crossref$$3journal-article$$a10.1021/jacs.4c09791$$bAmerican Chemical Society (ACS)$$d2024-11-04$$n45$$p30976-30989$$tJournal of the American Chemical Society$$v146$$x0002-7863$$y2024
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