New methods for automated NMR data analysis and protein structure determination [Elektronische Ressource] / von Dancea Felician

New Methods for Automated NMR DataAnalysis and Protein Structure DeterminationDissertationzur Erlangung des Doktorgradesder Naturwissenschaftenvorgelegt beim FachbereichChemische und Pharmazeutische Wissenschaften (FB 14)der Johann Wolfgang Goethe-Universit tin Frankfurt am MainvonDancea Felicianaus Aiud, Rum nienFrankfurt 2004(DF1)1vom Fachbereich Chemische und Pharmazeutische Wissenschaften (FB 14) derJohann Wolfgang Goethe-Universit t als Dissertation angenommen.Dekan: Prof. Dr. Harald SchwalbeGutachter: Prof. Dr. Heinz R terjansPD Dr. Ulrich G ntherDatum der Disputation: 10.03.20052AcknowledgementsIn the rst place I wish to thank my scienti c supervisors Prof. Dr. Heinz R terjansand PD Dr. Ulrich G nther for all their scienti c support and for giving me the chanceto pursuit this challenging work.I would like to acknowledge the contributions of several people who have helped meto carry out this work: Dr. Frank L hr for NMR experiments, PD Dr. Oliver Klimmekfor protein sample preparations, Dr. Hans Wienk for insightful discussions andsuggestions, Dr. Michael Nilges for help with ARIA-related computations, Dr. Yi-JanLin for help with the Sud project and Nikola Trbovic for the Wavepca collaboration.Special thanks to Prof. Dr. Volker D tsch for his kind support.Many thanks to all former and present BPC members: Joana Kleinhaus, Dr.Gary Yalloway, Mitch Maestre, Tanja Mittag, Lucia Muresanu, Alexander Koglin,Veronica Noskova, Dr.