Publications
2025
Rudolph, L., Krellmann, R., Castven, D., Jegodzinski, L., Deriš, H., Štambuk, J., Mölbitz, J., Dechent, L., Sperling, K., Lindloge, M., Friedrich, N., Schmelter, F., Föh, B., Trbojević-Akmačić, I., Sina, C., Nauck, M., Petersmann, A., Marquardt, J. U., Günther, U. L., & Mallagaray, A. (2025). Fast NMR-based assessment of cancer-associated protein glycosylations from serum samples. Analytical Chemistry, 97(17), 9367–9377.
2023
Creutznacher, R., Schulze-Niemand, E., König, P., Stanojlovic, V., Mallagaray, A., Peters, T., Stein, M., & Schubert, M. (2023). Conformational control of fast asparagine deamidation in a norovirus capsid protein. Biochemistry, 62(5), 1032–1043.
Mallagaray, A., Rudolph, L., Lindloge, M., Mölbitz, J., Thomsen, H., Schmelter, F., Alhabash, M. W., Abdullah, M. R., Saraei, R., Ehlers, M., Graf, T., Sina, C., Petersmann, A., Nauck, M., & Günther, U. L. (2023). Towards a precise NMR quantification of acute phase inflammation proteins from human serum. Angewandte Chemie – International Edition, 62(35), e202306154.
2022
Maass, T., Westermann, L. T., Creutznacher, R., Mallagaray, A., Dülfer, J., Uetrecht, C., & Peters, T. (2022). Assignment of Ala, Ile, LeuProS, Met, and ValProS methyl groups of the protruding domain of murine norovirus capsid protein VP1. Biomolecular NMR Assignments, 16(1), 97–107.
Maass, T., Ssebyatika, G., Brückner, M., Breckwoldt, L., Krey, T., Mallagaray, A., Peters, T., Frank, M., & Creutznacher, R. (2022). Binding of glycans to the SARS-CoV-2 spike protein: NMR data on binding site localization, affinity, and selectivity. Chemistry – A European Journal, 28(71), e202202614.
Creutznacher, R., Maass, T., Dülfer, J., Feldmann, C., Hartmann, V., Lane, M. S., Knickmann, J., Westermann, L. T., Thiede, L., Smith, T. J., Uetrecht, C., Mallagaray, A., Waudby, C. A., Taube, S., & Peters, T. (2022). Distinct dissociation rates of murine and human norovirus P-domain dimers. Communications Biology, 5, 563.
Peters, T., Creutznacher, R., Maass, T., Mallagaray, A., Ogrissek, P., Taube, S., Thiede, L., & Uetrecht, C. (2022). Norovirus–glycan interactions: How strong are they really? Biochemical Society Transactions, 50(1), 347–359.
2021
Dülfer, J., Yan, H., Brodmerkel, M. N., Creutznacher, R., Mallagaray, A., Peters, T., Caleman, C., Marklund, E. G., & Uetrecht, C. (2021). Glycan-induced protein dynamics in human norovirus P dimers. Molecules, 26(8), 2125.
Schmelter, F., Föh, B., Mallagaray, A., Rahmöller, J., Ehlers, M., Lehrian, S., von Kopylow, V., Künsting, I., Lixenfeld, A. S., Martin, E., Ragab, M., Meyer-Saraei, R., Kreutzmann, F., Eitel, I., Taube, S., Käding, N., Jantzen, E., Graf, T., Sina, C., & Günther, U. L. (2021). Metabolic and lipidomic markers differentiate COVID-19 from other ICU patients. Frontiers in Molecular Biosciences, 8, 737039.
Creutznacher, R., Maass, T., Ogrissek, P., Wallmann, G., Feldmann, C., Peters, H., Lingemann, M., Taube, S., Peters, T., & Mallagaray, A. (2021). NMR experiments shed new light on glycan recognition by human and murine norovirus capsid proteins. Viruses, 13(3), 416.
Yan, H., Lockhauserbäumer, J., Szekeres, G. P., Mallagaray, A., Creutznacher, R., Taube, S., Peters, T., Pagel, K., & Uetrecht, C. (2021). Protein secondary structure affects glycan clustering in native mass spectrometry. Life, 11(6), 554.
2020
Creutznacher, R., Schulze, E., Wallmann, G., Peters, T., Stein, M., & Mallagaray, A. (2020). Chemical-shift perturbations reflect bile acid binding to norovirus coat protein. ChemBioChem, 21(7), 1007–1021.
Müller-Hermes, C., Creutznacher, R., & Mallagaray, A. (2020). Complete assignment of methyl groups of the protruding domain from human norovirus GII.4 Saga. Biomolecular NMR Assignments, 14(1), 123–130.
Mende, M., Tsouka, A., Heidepriem, J., Paris, G., Mattes, D. S., Eickelmann, S., Bordoni, V., Wawrzinek, R., Fuchsberger, F. F., Seeberger, P. H., Rademacher, C., Delbianco, M., Mallagaray, A., & Loeffler, F. F. (2020). On-chip neo-glycopeptide synthesis for multivalent glycan presentation. Chemistry – A European Journal, 26(44), 9954–9963.
2019
Mallagaray, A., Creutznacher, R., Dülfer, J., Mayer, P. H. O., Grimm, L. L., Orduña, J. M., Trabjerg, E., Stehle, T., Rand, K. D., Blaum, B. S., Uetrecht, C., & Peters, T. (2019). A post-translational modification of human norovirus capsid protein attenuates glycan binding. Nature Communications, 10, 1320.
2018
Bücher, K. S., Yan, H., Creutznacher, R., Ruoff, K., Mallagaray, A., Grafmüller, A., Dirks, J. S., Kilic, T., Weickert, S., Rubailo, A., Drescher, M., Schmidt, S., Hansman, G., Peters, T., Uetrecht, C., & Hartmann, L. (2018). Fucose-functionalized precision glycomacromolecules targeting human norovirus capsid protein. Biomacromolecules, 19(9), 3714–3724.
Taube, S., Mallagaray, A., & Peters, T. (2018). Norovirus, glycans and attachment. Current Opinion in Virology, 31, 33–42.
2017
Wegener, H., Mallagaray, Á., Schöne, T., Peters, T., Lockhauserbäumer, J., Yan, H., Uetrecht, C., Hansman, G. S., & Taube, S. (2017). Human norovirus GII.4 P dimer binds fucosylated and sialylated carbohydrates. Glycobiology, 27(11), 1027–1037.
Mallagaray, A., Rademacher, C., Parra, F., Hansman, G., & Peters, T. (2017). Saturation transfer difference NMR titrations reveal multistep binding of L-fucose to norovirus particles. Glycobiology, 27(1), 80–86.
2016
Mallagaray, A., Domínguez, G., Peters, T., & Pérez-Castells, J. (2016). A rigid lanthanide binding tag to aid NMR studies of a 70 kDa homodimeric coat protein of human norovirus. Chemical Communications, 52(3), 601–604.
Unione, L., Ortega, G., Mallagaray, A., Corzana, F., Pérez-Castells, J., Canales, A., Jiménez-Barbero, J., & Millet, O. (2016). Conformational landscape of ligand binding to glucose/galactose-binding protein. ACS Chemical Biology, 11(8), 2149–2157.
2015
Mallagaray, A., Lockhauserbäumer, J., Hansman, G., Uetrecht, C., & Peters, T. (2015). Attachment of norovirus to histo blood group antigens: A cooperative multistep process. Angewandte Chemie – International Edition, 54(41), 12014–12019.
Kini, S. G., Nguyen, P. Q. T., Weissbach, S., Mallagaray, A., Shin, J., Yoon, H. S., & Tam, J. P. (2015). Chitin-binding property of novel cysteine-rich peptides from Alternanthera sessilis. Biochemistry, 54(43), 6639–6649.
2014
Canales, Á., Mallagaray, Á., Berbís, M. Á., Navarro-Vázquez, A., Domínguez, G., Cañada, F. J., André, S., Gabius, H. J., Pérez-Castells, J., & Jiménez-Barbero, J. (2014). Lanthanide-chelating carbohydrate conjugates for structural and interaction studies. Journal of the American Chemical Society, 136(22), 8011–8017.
2013
Canales, A., Mallagaray, A., Pérez-Castells, J., Boos, I., Unverzagt, C., André, S., Gabius, H. J., Cañada, F. J., & Jiménez-Barbero, J. (2013). Breaking pseudo-symmetry in multiantennary N-glycans. Angewandte Chemie – International Edition, 52(51), 13789–13793.
2012
Mallagaray, Á., Mohammadiannejad-Abbasabadi, K., Medina, S., Domínguez, G., & Pérez-Castells, J. (2012). Cycloisomerization of dienes and enynes catalysed by a modified ruthenium carbene species. Organic and Biomolecular Chemistry, 10(33), 6665–6672.
2011
Mallagaray, A., Canales, A., Domínguez, G., Jiménez-Barbero, J., & Pérez-Castells, J. (2011). A rigid lanthanide binding tag for NMR analysis of carbohydrates. Chemical Communications, 47(25), 7179–7181.
2010
Mallagaray, Á., Medina, S., Domínguez, G., & Pérez-Castells, J. (2010). Ruthenium carbene mediated [2+2+2] cyclotrimerizations. Synlett, 14, 2114–2118.
2008
Mallagaray, Á., Domínguez, G., Gradillas, A., & Pérez-Castells, J. (2008). Tandem RCM–isomerization–cyclopropanation reactions. Organic Letters, 10(4), 597–600.

