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  • Protein-ligand binding can induce the formation of cryptic allosteric pockets not found in the unbound protein, but predicting this computationally can be challenging. Here a combined computational and experimental workflow identifies ligands for H. pyloriglutamate racemase, finding that coupled dynamics of the enzyme dimer are dampened by ligand binding.

    • Pratik Rajesh Chheda
    • Grant T. Cooling
    • M. Ashley Spies
    ArticleOpen Access
  • Photo-induced darkening of red cinnabar (α-HgS) often dramatically changes the appearance of artworks, but the reduction mechanism of Hg2+ remains unclear. Here, the authors propose an alternative pathway for the blackening reaction of cinnabar, considering its semiconductor properties and pigment-binder interactions

    • Kerstin Elert
    • Manuel Pérez Mendoza
    • Carolina Cardell
    ArticleOpen Access
  • The transfer of chiral information from optically pure reaction components to products can generate enantiomerically-enriched molecules, but the control of stereochemistry often proves challenging. Here, the author highlights how our fundamental understanding of stereocontrol has evolved and discusses possible approaches for the rational development of enantioselective catalysts.

    • Jolene P. Reid
    CommentOpen Access
  • In situ and real-time characterization of dynamic airborne particles is important for fundamental as well as applied atmospheric chemistry, but imaging usually requires trapping the particles. Here the authors use an integrated digital in-line holographic microscope coupled with a flow tube to study moving <200 nm-sized particles without optical traps.

    • Devendra Pal
    • Yevgen Nazarenko
    • Parisa A. Ariya
    ArticleOpen Access
  • Bismuth organic frameworks can display interesting phosphorescent properties, but the relationship between structure and optical activity remains underexplored. Here two bismuth organic frameworks with differing bismuth coordination number and intermetallic distance are contrasted.

    • Jin Young Koo
    • Changmin Lee
    • Hee Cheul Choi
    ArticleOpen Access
  • Phosphatidylinositol-4,5-bisphosphates are involved in membrane regulation and signalling in eukaryotes, with the distribution of acyl chains changing in response to stimuli. Here, molecular dynamics simulations and fluorescence spectroscopy experiments show that increasing acyl chain saturation increases the ordering of lipid nanodomains in artificial membranes.

    • Luís Borges-Araújo
    • Marco M. Domingues
    • Fábio Fernandes
    ArticleOpen Access
  • Small changes in protein structure can have pronounced effects on protein–protein interactions, but quantifying this has only recently become possible. Now, the binding landscapes of three homologous enzyme–inhibitor complexes are quantified and shown to depend on whether the inhibitor binds its natural target or a structurally similar protein.

    • Andrew J. Bissette
    Research HighlightOpen Access
  • Synthetic models of cells are becoming increasingly sophisticated, but engineering communication between these and living cells remains challenging. Here the authors review modes of communication and signal processing between living cells and synthetic analogs, such as giant unilamellar vesicles, proteinosomes, and coacervates.

    • Vincent Mukwaya
    • Stephen Mann
    • Hongjing Dou
    Review ArticleOpen Access
  • Landomycins are promising anti-cancer agents with the potential to bypass common resistance pathways, but their mechanism of action remains incompletely understood. Here a mechanism is proposed involving intracellular sequential thiol-Michael and oxidation reactions, which depletes endogenous thiols and induces reactive oxygen species formation.

    • Alessio Terenzi
    • Mery La Franca
    • Walter Berger
    ArticleOpen Access
  • Copper-catalysed annulation of allenylidenes provides an opportunity to target the alpha, beta, or gamma positions of the allenylidene, but achieving this control is challenging. Here substrate control allows selectivity between these three positions in the enantioselective cyclisation of ethynyl benzoxazinanones and sulfamate-derived cyclic imines.

    • Malla Reddy Gannarapu
    • Takanori Imai
    • Norio Shibata
    ArticleOpen Access
  • n-type organic semiconductors exhibiting two-dimensional isotropic charge transport are rarely reported. Here the authors show that using bulky substituents, BQQDI demonstrates near-isotropic charge transport, resilience to dynamic disorder, as well as high electron mobility both in single- and polycrystalline thin-film transistors.

    • Craig P. Yu
    • Naoya Kojima
    • Toshihiro Okamoto
    ArticleOpen Access
  • Chemical reactions often require multiple random encounters between reactants, but a general, analytical treatment such imperfect transport-limited/influenced reactions in confined spaces has not yet been proposed. Here, the authors predict the full kinetics of these reactions for Markovian processes in large confining volumes.

    • Thomas Guérin
    • Maxim Dolgushev
    • Raphaël Voituriez
    ArticleOpen Access