SANCHEZ-PEDREGAL, Victor M, Karel KUBÍČEK, Jens MEILER, Isabelle LYOTHIER, Ian PATERSON and Teresa CARLOMAGNO. The tubulin-bound conformation of discodermolide derived by NMR studies in solution supports a common pharmacophore model for epothilone and discodermolide. Angewandte Chemie International Edition. Weinheim: Wiley-VCH Verlag GmbH & Co., 2006, vol. 45, No 44, p. 7388-7394. ISSN 1433-7851. |
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@article{724892, author = {SanchezandPedregal, Victor M and Kubíček, Karel and Meiler, Jens and Lyothier, Isabelle and Paterson, Ian and Carlomagno, Teresa}, article_location = {Weinheim}, article_number = {44}, keywords = {conformation analysis; discodermolide; NMR spectroscopy; structure-activity relationships; tubulin}, language = {eng}, issn = {1433-7851}, journal = {Angewandte Chemie International Edition}, title = {The tubulin-bound conformation of discodermolide derived by NMR studies in solution supports a common pharmacophore model for epothilone and discodermolide}, url = {http://www3.interscience.wiley.com/cgi-bin/abstract/113394631/ABSTRACT?CRETRY=1&SRETRY=0}, volume = {45}, year = {2006} }
TY - JOUR ID - 724892 AU - Sanchez-Pedregal, Victor M - Kubíček, Karel - Meiler, Jens - Lyothier, Isabelle - Paterson, Ian - Carlomagno, Teresa PY - 2006 TI - The tubulin-bound conformation of discodermolide derived by NMR studies in solution supports a common pharmacophore model for epothilone and discodermolide JF - Angewandte Chemie International Edition VL - 45 IS - 44 SP - 7388-7394 EP - 7388-7394 PB - Wiley-VCH Verlag GmbH & Co. SN - 14337851 KW - conformation analysis KW - discodermolide KW - NMR spectroscopy KW - structure-activity relationships KW - tubulin UR - http://www3.interscience.wiley.com/cgi-bin/abstract/113394631/ABSTRACT?CRETRY=1&SRETRY=0 N2 - Bound to have similarities: Although the overall shape of discodermolide bound to tubulin resembles the structure of the free ligand, the precise conformation and orientation of the lactone ring are different. A partially overlapping pharmacophore model supported by protein-mediated interligand NOE signals is proposed to explain the similar (but not fully equivalent) biological activity of discodermolide and epothilone A. ER -
SANCHEZ-PEDREGAL, Victor M, Karel KUBÍČEK, Jens MEILER, Isabelle LYOTHIER, Ian PATERSON and Teresa CARLOMAGNO. The tubulin-bound conformation of discodermolide derived by NMR studies in solution supports a common pharmacophore model for epothilone and discodermolide. \textit{Angewandte Chemie International Edition}. Weinheim: Wiley-VCH Verlag GmbH \&{} Co., 2006, vol.~45, No~44, p.~7388-7394. ISSN~1433-7851.
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