Publications of T. Carlomagno

Orts, J.; Bartoschek, S.; Griesinger, C.; Monecke, P.; Carlomagno, T.: An NMR-based scoring function improves the accuracy of binding pose predictions by docking by two orders of magnitude. Journal of Biomolecular NMR 52 (1), pp. 23 - 30 (2012)

Dervillez, X.; Klaukien, V.; Duerr, R.; Koch, J.; Kreutz, A.; Haarmann, T.; Stoll, M.; Lee, D.; Carlomagno, T.; Schnierle, B. et al.; Moebius, K.; Koenigs, C.; Griesinger, C.; Dietrich, U.: Peptide ligands selected with CD4-induced epitopes on native dualtropic HIV-1 envelope proteins mimic extracellular coreceptor domains and bind to HIV-1 gp120 independently of coreceptor usage. Journal of Virology 84 (19), pp. 10131 - 10138 (2010)

Erdelyi, M.; Navarro-Vazquez, A.; Pfeiffer, B.; Kuzniewski, C. N.; Felser, A.; Widmer, T.; Gertsch, J.; Pera, B.; Diaz, J. F.; Altmann, K. H. et al.; Carlomagno, T.: The binding mode of side chain- and C3-modified epothilones to tubulin. ChemMedChem 5 (6), pp. 911 - 920 (2010)

Bartoschek, S.; Klabunde, T.; Defossa, E.; Dietrich, V.; Stengelin, S.; Griesinger, C.; Carlomagno, T.; Focken, I.; Wendt, K. U.: Drug design for G-protein-coupled receptors by a ligand-based NMR method. Angewandte Chemie International Edition 49 (8), pp. 1426 - 1429 (2010)

Rodriguez-Castaneda, F.; Maestre Martinez, M.; Coudevylle, N.; Dimova, K.; Junge, H.; Lipstein, N.; Lee, D.; Becker, S.; Brose, N.; Jahn, O. et al.; Carlomagno, T.; Griesinger, C.: Modular architecture of Munc13/calmodulin complexes: Dual regulation by Ca2+ and possible function in short-term synaptic plasticity. The EMBO Journal 29, pp. 680 - 691 (2010)

Orts, J.; Griesinger, C.; Carlomagno, T.: The INPHARMA technique for pharmacophore mapping: A theoretical guide to the method. Journal of Magnetic Resonance 200 (1), pp. 64 - 73 (2009)

Li, P.; Kirkpatrick, J. P.; Carlomagno, T.: An efficient strategy for the determination of the three-dimensional architecture of ribonucleoprotein complexes by the combination of a few easily accessible NMR and biochemical data: intermolecular recognition in a U4 spliceosomal complex. Journal of Molecular Biology 388 (2), pp. 283 - 298 (2009)

Kirkpatrick, J. P.; Li, P.; Carlomagno, T.: Probing mutation-induced structural perturbations by refinement against residual dipolar couplings: application to the U4 spliceosomal RNP complex. ChemBioChem 10 (6), pp. 1007 - 1014 (2009)

Carlomagno, T.; Amata, I.; Williamson, J. R.; Hennig, M.: NMR assignments of HIV-2 TAR RNA. Biomolecular NMR Assigments 2 (2), pp. 167 - 169 (2008)

Orts, J.; Tuma, J.; Reese, M.; Grimm, S. K.; Monecke, P.; Bartoschek, S.; Schiffer, A.; Wendt, U.; Griesinger, C.; Carlomagno, T.: Crystallography-independent determination of ligand binding modes. Angewandte Chemie International Edition 47 (40), pp. 7736 - 7740 (2008)

Hoefer, P.; Carl, P.; Guthausen, G.; Prisner, T.; Carlomagno, T.; Reese, M.; Griesinger, C.; Bennati, M.: Studies of dynamic nuclear polarization with nitroxides in aqueous solution. Applied Magnetic Resonance 34 (3-4), pp. 393 - 398 (2008)

Reese, M.; Lennartz, D.; Marquardsen, T.; Hoefer, P.; Tavernier, A.; Carl, P.; Schippmann, T.; Bennati, M.; Carlomagno, T.; Engelke, F. et al.; Griesinger, C.: Construction of a liquid-state NMR DNP shuttle spectrometer: first experimental results and evaluation of optimal performance characteristics. Applied Magnetic Resonance 34 (3-4), pp. 301 - 311 (2008)

Nickeleit, I.; Zender, S.; Sasse, E.; Geffers, R.; Brandes, G.; Soerensen, I.; Steinmetz, H.; Kubicka, S.; Carlomagno, T.; Menche, D. et al.; Guetgemann, I.; Buer, J.; Gossler, A.; Manns, M. P.; Kalesse, M.; Frank, R.; Malek, N. P.: Argyrin a reveals a critical role for the tumor suppressor protein p27^kip1 in mediating antitumor activities in response to proteasome inhibition. Cancer Cell 14 (1), pp. 23 - 35 (2008)

Hoefer, P.; Parigi, G.; Luchinat, C.; Carl, P.; Guthausern, G.; Carlomagno, T.; Reese, M.; Griesinger, C.; Bennati, M.: Field dependent dynamic nuclear polarization with radicals in aqueous solution. Journal of the American Chemical Society 130 (11), pp. 3254 - 3255 (2008)

Erdelyi, M.; Pfeiffer, B.; Hauenstein, K.; Fohrer, J.; Gertsch, J.; Altmann, K. H.; Carlomagno, T.: Conformational preferences of natural and C3-modified epothilones in aqueous solution. Journal of Medicinal Chemistry 51 (5), pp. 1469 - 1473 (2008)

Fares, C.; Hassfeld, J.; Menche, D.; Carlomagno, T.: Simultaneous determination of the conformation and relative configuration of archazolide A by using nuclear Overhauser effects, J couplings, and residual dipolar couplings. Angewandte Chemie International Edition 47 (20), pp. 3722 - 3726 (2008)

Fares, C.; Amata, I.; Carlomagno, T.: ¹³C-Detection in RNA bases: Revealing structure-chemical shift relationships. Journal of the American Chemical Society 129 (51), pp. 15814 - 15823 (2007)

Liu, S.; Li, P.; Dybkov, O.; Nottrott, S.; Hartmuth, K.; Luehrmann, R.; Carlomagno, T.; Wahl, M. C.: Binding of the human Prp31 nop domain to a composite RNA-protein platform in U4 snRNP. Science 316, 5821, pp. 115 - 120 (2007)

Reese, M.; Sanchez-Pedregal, V. M.; Kubicek, K.; Meiler, J.; Blommers, M. J. J.; Griesinger, C.; Carlomagno, T.: Structural basis of the activity of the microtubule-stabilizing agent epothilone A studied by NMR spectroscopy in solution. Angewandte Chemie-International Edition 46 (11), pp. 1864 - 1868 (2007)

Lange, A.; Schupp, T.; Petersen, F.; Carlomagno, T.; Baldus, M.: High-resolution solid-state NMR structure of an anticancer agent. ChemMedChem 2 (4), pp. 522 - 527 (2007)