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Gaussian processes for autonomous data acquisition at large-scale synchrotron and neutron facilities
The execution and analysis of complex experiments are challenged by the vast dimensionality of the underlying parameter spaces. Although an increase in data-acquisition rates should allow broader querying of t...
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Article
Open AccessFree-electron laser data for multiple-particle fluctuation scattering analysis
Fluctuation X-ray scattering (FXS) is an emerging experimental technique in which solution scattering data are collected using X-ray exposures below rotational diffusion times, resulting in angularly anisotrop...
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Structure of photosystem II and substrate binding at room temperature
The structures of three intermediate states of photosystem II, which is crucial for photosynthesis, have been solved at room temperature, shedding new light on this process.
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No observable conformational changes in PSII
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Correction: Corrigendum: Accurate macromolecular structures using minimal measurements from X-ray free-electron lasers
Nat. Methods 11, 545–548 (2014); published online 16 March 2014; corrected after print 3 June 2015 In the version of this article initially published, the authors claimed that with the tool cctbx.xfel, weak di...
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Taking snapshots of photosynthetic water oxidation using femtosecond X-ray diffraction and spectroscopy
The dioxygen we breathe is formed by light-induced oxidation of water in photosystem II. O2 formation takes place at a catalytic manganese cluster within milliseconds after the photosystem II reaction centre is e...
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Accurate macromolecular structures using minimal measurements from X-ray free-electron lasers
A computational approach and software tool, cctbx.xfel, enables the determination of accurate macromolecular structure factors using a relatively small number of serial femtosecond crystallography diffraction ...
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Studies of IscR reveal a unique mechanism for metal-dependent regulation of DNA binding specificity
The bacterial metalloregulator IscR possesses the unusual ability to direct differential gene expression via specific recognition of two distinct operator motifs in an Fe-S–dependent manner. New work shows tha...
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Hybrid molecular structure of the giant protease tripeptidyl peptidase II
Tripeptidyl peptidase II is an eukaryotic serine protease that forms huge, spindle-shaped homopolymeric complexes, whose building block is an enzymatically inactive dimer. Now a combination of cryo-EM and crys...