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Engineering of a functional γ-tocopherol transfer protein
Aeschimann, W., Kammer, S., Staats, S., Schneider, P., Schneider, G., Rimbach, G., … Stocker, A. (2021). Engineering of a functional γ-tocopherol transfer protein. Redox Biology, 38, 101773 (11 pp.). https://doi.org/10.1016/j.redox.2020.101773
Biosynthesis of the tricyclic aromatic type II polyketide rishirilide: new potential third ring oxygenation after three cyclization steps
Alali, A., Zhang, L., Li, J., Zuo, C., Wassouf, D., Yan, X., … Bechthold, A. (2021). Biosynthesis of the tricyclic aromatic type II polyketide rishirilide: new potential third ring oxygenation after three cyclization steps. Molecular Biotechnology. https://doi.org/10.1007/s12033-021-00314-x
Crystal structure and subsequent ligand design of a nonriboside partial agonist bound to the adenosine A<sub>2A</sub> receptor
Amelia, T., van Veldhoven, J. P. D., Falsini, M., Liu, R., Heitman, L. H., van Westen, G. J. P., … IJzerman, A. P. (2021). Crystal structure and subsequent ligand design of a nonriboside partial agonist bound to the adenosine A2A receptor. Journal of Medicinal Chemistry. https://doi.org/10.1021/acs.jmedchem.0c01856
Ancestral reconstruction of mammalian FMO1 enables structural determination, revealing unique features that explain its catalytic properties
Bailleul, G., Nicoll, C. R., Mascotti, M. L., Mattevi, A., & Fraaije, M. W. (2021). Ancestral reconstruction of mammalian FMO1 enables structural determination, revealing unique features that explain its catalytic properties. Journal of Biological Chemistry, 296, 100221 (13 pp.). https://doi.org/10.1074/jbc.RA120.016297
An antibiotic-resistance conferring mutation in a neisserial porin: Structure, ion flux, and ampicillin binding
Bartsch, A., Ives, C. M., Kattner, C., Pein, F., Diehn, M., Tanabe, M., … Llabrés, S. (2021). An antibiotic-resistance conferring mutation in a neisserial porin: Structure, ion flux, and ampicillin binding. Biochimica et Biophysica Acta: Biomembranes, 1863(6), 183601 (11 pp.). https://doi.org/10.1016/j.bbamem.2021.183601
Conformational editing of intrinsically disordered protein by α-methylation
Bauer, V., Schmidtgall, B., Gógl, G., Dolenc, J., Osz, J., Nominé, Y., … Torbeev, V. (2021). Conformational editing of intrinsically disordered protein by α-methylation. Chemical Science, 12(3), 1080-1089. https://doi.org/10.1039/D0SC04482B
Design of buried charged networks in artificial proteins
Baumgart, M., Röpke, M., Mühlbauer, M. E., Asami, S., Mader, S. L., Fredriksson, K., … Kaila, V. R. I. (2021). Design of buried charged networks in artificial proteins. Nature Communications, 12, 1895 (9 pp.). https://doi.org/10.1038/s41467-021-21909-7
CYP154C5 regioselectivity in steroid hydroxylation explored by substrate modifications and protein engineering
Bracco, P., Wijma, H. J., Nicolai, B., Rodriguez Buitrago, J. A., Klünemann, T., Vila, A., … Schallmey, A. (2021). CYP154C5 regioselectivity in steroid hydroxylation explored by substrate modifications and protein engineering. ChemBioChem, 22(6), 1099-1110. https://doi.org/10.1002/cbic.202000735
Nonsteroidal ecdysone receptor agonists use a water channel for binding to the ecdysone receptor complex EcR/USP
Browning, C., McEwen, A. G., Mori, K., Yokoi, T., Moras, D., Nakagawa, Y., & Billas, I. M. L. (2021). Nonsteroidal ecdysone receptor agonists use a water channel for binding to the ecdysone receptor complex EcR/USP. Journal of Pesticide Science, 46(1), 88-100. https://doi.org/10.1584/jpestics.D20-095
Crystal structure of bacterial cytotoxic necrotizing factor CNF&lt;sub&gt;Y&lt;/sub&gt; reveals molecular building blocks for intoxication
Chaoprasid, P., Lukat, P., Mühlen, S., Heidler, T., Gazdag, E. M., Dong, S., … Blankenfeldt, W. (2021). Crystal structure of bacterial cytotoxic necrotizing factor CNFY reveals molecular building blocks for intoxication. EMBO Journal, 40(4), e105202 (21 pp.). https://doi.org/10.15252/embj.2020105202
Structural basis for targeting the folded P-loop conformation of c-MET
Collie, G. W., Michaelides, I. N., Embrey, K., Stubbs, C. J., Börjesson, U., Dale, I. L., … Storer, R. I. (2021). Structural basis for targeting the folded P-loop conformation of c-MET. ACS Medicinal Chemistry Letters, 12(1), 162-167. https://doi.org/10.1021/acsmedchemlett.0c00392
Mechanistic insights into the synergistic activation of the RXR–PXR heterodimer by endocrine disruptor mixtures
Delfosse, V., Huet, T., Harrus, D., Granell, M., Bourguet, M., Gardia-Parège, C., … Bourguet, W. (2021). Mechanistic insights into the synergistic activation of the RXR–PXR heterodimer by endocrine disruptor mixtures. Proceedings of the National Academy of Sciences of the United States of America PNAS, 118(1), e2020551118 (10 pp.). https://doi.org/10.1073/PNAS.2020551118
Complexes of the neurotensin receptor 1 with small-molecule ligands reveal structural determinants of full, partial, and inverse agonism
Deluigi, M., Klipp, A., Klenk, C., Merklinger, L., Eberle, S. A., Morstein, L., … Plückthun, A. (2021). Complexes of the neurotensin receptor 1 with small-molecule ligands reveal structural determinants of full, partial, and inverse agonism. Science Advances, 7(5), eabe5504 (15 pp.). https://doi.org/10.1126/sciadv.abe5504
Structure based design of bicyclic Peptide inhibitors of RbAp48
Hart, P. 't., Hommen, P., Noisier, A., Krzyzanowski, A., Schüler, D., Porfetye, A. T., … Waldmann, H. (2021). Structure based design of bicyclic Peptide inhibitors of RbAp48. Angewandte Chemie International Edition, 60(4), 1813-1820. https://doi.org/10.1002/anie.202009749
Novel inhibitors of nicotinamide-&lt;em&gt;N&lt;/em&gt;-methyltransferase for the treatment of metabolic disorders
Kannt, A., Rajagopal, S., Hallur, M. S., Swamy, I., Kristam, R., Dhakshinamoorthy, S., … Ruf, S. (2021). Novel inhibitors of nicotinamide-N-methyltransferase for the treatment of metabolic disorders. Molecules, 26(4), 991 (22 pp.). https://doi.org/10.3390/molecules26040991
High-temperature treatments of niobium under high vacuum, dilute air- and nitrogen-atmospheres as investigated by &lt;em&gt;in situ&lt;/em&gt; X-ray absorption spectroscopy
Klaes, J., Rothweiler, P., Bornmann, B., Wagner, R., & Lützenkirchen-Hecht, D. (2021). High-temperature treatments of niobium under high vacuum, dilute air- and nitrogen-atmospheres as investigated by in situ X-ray absorption spectroscopy. Journal of Synchrotron Radiation, 28, 266-277. https://doi.org/10.1107/S1600577520013557
Gas channel rerouting in a primordial enzyme: structural insights of the carbon-monoxide dehydrogenase/acetyl-CoA synthase complex from the acetogen &lt;em&gt;Clostridium autoethanogenum&lt;/em&gt;
Lemaire, O. N., & Wagner, T. (2021). Gas channel rerouting in a primordial enzyme: structural insights of the carbon-monoxide dehydrogenase/acetyl-CoA synthase complex from the acetogen Clostridium autoethanogenum. Biochimica et Biophysica Acta: Bioenergetics, 1862(1), 148330 (14 pp.). https://doi.org/10.1016/j.bbabio.2020.148330
Atomistic and thermodynamic analysis of N6-methyladenosine (m&lt;sup&gt;6&lt;/sup&gt;A) recognition by the reader domain of YTHDC1
Li, Y., Bedi, R. K., Wiedmer, L., Sun, X., Huang, D., & Caflisch, A. (2021). Atomistic and thermodynamic analysis of N6-methyladenosine (m6A) recognition by the reader domain of YTHDC1. Journal of Chemical Theory and Computation. https://doi.org/10.1021/acs.jctc.0c01136
Human species D adenovirus hexon capsid protein mediates cell entry through a direct interaction with CD46
Persson, B. D., John, L., Rafie, K., Strebl, M., Frängsmyr, L., Ballmann, M. Z., … Arnberg, N. (2021). Human species D adenovirus hexon capsid protein mediates cell entry through a direct interaction with CD46. Proceedings of the National Academy of Sciences of the United States of America PNAS, 118(3), e2020732118 (8 pp.). https://doi.org/10.1073/pnas.2020732118
Surfactant-free synthesis of size controlled platinum nanoparticles: Insights from &lt;em&gt;in situ&lt;/em&gt; studies
Quinson, J., Dworzak, A., Simonsen, S. B., Theil Kuhn, L., Jensen, K. M. Ø., Zana, A., … Arenz, M. (2021). Surfactant-free synthesis of size controlled platinum nanoparticles: Insights from in situ studies. Applied Surface Science, 549, 149263 (9 pp.). https://doi.org/10.1016/j.apsusc.2021.149263
 

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