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Bernhard Jaun

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TOP 3
Silvan Scheller; Meike Goenrich; Stefan Mayr; Rudolf K Thauer; Bernhard Jaun
Intermediates in the catalytic cycle of methyl coenzyme M reductase: isotope exchange is consistent with formation of a σ-alkane-nickel complex.
Marc-Olivier Ebert; Bernhard Jaun
Oligonucleotides with sugars other than ribo- and 2'-deoxyribofuranose in the backbone: the solution structures determined by NMR in the context of the 'Etiology of nucleic acids' project of Albert Eschenmoser.
Silvan Scheller; Meike Goenrich; Reinhard Boecher; Rudolf K Thauer; Bernhard Jaun
The key nickel enzyme of methanogenesis catalyses the anaerobic oxidation of methane.

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All Publications

2010: Silvan Scheller; Meike Goenrich; Stefan Mayr; Rudolf K Thauer; Bernhard Jaun
Intermediates in the catalytic cycle of methyl coenzyme M reductase: isotope exchange is consistent with formation of a σ-alkane-nickel complex.
Angewandte Chemie (International ed. in English) 2010;49(44):8112-5.
2010: Marc-Olivier Ebert; Bernhard Jaun
Oligonucleotides with sugars other than ribo- and 2'-deoxyribofuranose in the backbone: the solution structures determined by NMR in the context of the 'Etiology of nucleic acids' project of Albert Eschenmoser.
Chemistry & biodiversity 2010;7(9):2103-28.
2010: Silvan Scheller; Meike Goenrich; Reinhard Boecher; Rudolf K Thauer; Bernhard Jaun
The key nickel enzyme of methanogenesis catalyses the anaerobic oxidation of methane.
Nature 2010;465(7298):606-8.
2010: Ulf-Peter Apfel; Manfred Rudolph; Christina Apfel; Christian Robl; Daniel Langenegger; Daniel Hoyer; Bernhard Jaun; Marc-Olivier Ebert; Theodor Alpermann; Dieter Seebach; Wolfgang Weigand
Reaction of Fe3(CO)12 with octreotide--chemical, electrochemical and biological investigations.
Dalton transactions (Cambridge, England : 2003) 2010;39(12):3065-71.
2010: Sieglinde Ebner; Bernhard Jaun; Meike Goenrich; Rudolf K Thauer; Jeffrey Harmer
Binding of coenzyme B induces a major conformational change in the active site of methyl-coenzyme M reductase.
Journal of the American Chemical Society 2010;132(2):567-75.
2009: Dongqi Wang; Bernhard Jaun; Wilfred F van Gunsteren
Folding and unfolding of two mixed alpha/beta peptides.
Chembiochem : a European journal of chemical biology 2009;10(12):2032-41.
2009: Zrinka Gattin; Julian Schwartz; Raveendra I Mathad; Bernhard Jaun; Wilfred F van Gunsteren
Interpreting experimental data by using molecular simulation instead of model building.
Chemistry (Weinheim an der Bergstrasse, Germany) 2009;15(26):6389-98.
2009: Caroline Aldag; Igor A Gromov; Inés García-Rubio; Konstanze von Koenig; Ilme Schlichting; Bernhard Jaun; Donald Hilvert
Probing the role of the proximal heme ligand in cytochrome P450cam by recombinant incorporation of selenocysteine.
Proceedings of the National Academy of Sciences of the United States of America 2009;106(14):5481-6.
2009: Bernhard Jaun; Rudolf K Thauer
Nickel-alkyl bond formation in the active site of methyl-coenzyme m reductase.
Metal ions in life sciences 2009;6():115-32.
2008: Marc-Olivier Ebert; Christian Mang; Ramanarayanan Krishnamurthy; Albert Eschenmoser; Bernhard Jaun
The structure of a TNA-TNA complex in solution: NMR study of the octamer duplex derived from alpha-(L)-threofuranosyl-(3'-2')-CGAATTCG.
Journal of the American Chemical Society 2008;130(45):15105-15.
2008: Dariush Hinderberger; Sieglinde Ebner; Stefan Mayr; Bernhard Jaun; Markus Reiher; Meike Goenrich; Rudolf K Thauer; Jeffrey Harmer
Coordination and binding geometry of methyl-coenzyme M in the red1m state of methyl-coenzyme M reductase.
Journal of biological inorganic chemistry : JBIC : a publication of the Society of Biological Inorganic Chemistry 2008;13(8):1275-89.
2008: Jeffrey Harmer; Cinzia Finazzo; Rafal Piskorski; Sieglinde Ebner; Evert C Duin; Meike Goenrich; Rudolf K Thauer; Markus Reiher; Arthur Schweiger; Dariush Hinderberger; Bernhard Jaun
A nickel hydride complex in the active site of methyl-coenzyme m reductase: implications for the catalytic cycle.
Journal of the American Chemical Society 2008;130(33):10907-20.
2008: Stefan Mayr; Christopher Latkoczy; Martin Krüger; Detlef Günther; Seigo Shima; Rudolf K Thauer; Friedrich Widdel; Bernhard Jaun
Structure of an F430 variant from archaea associated with anaerobic oxidation of methane.
Journal of the American Chemical Society 2008;130(32):10758-67.
2008: Stefan Mayr; Detlef Günther; Bernhard Jaun; W Bernd Schweizer
Sodium 2-mercaptoethanesulfonate monohydrate (coenzyme M sodium salt monohydrate).
Acta crystallographica. Section E, Structure reports online 2008;64(Pt 11):m1476-7.
2008: Zeena Johar; Alain Zahn; Christian J Leumann; Bernhard Jaun
Solution structure of a DNA duplex containing a biphenyl pair.
Chemistry (Weinheim an der Bergstrasse, Germany) 2008;14(4):1080-6.
2007: Denise I Kern; Meike Goenrich; Bernhard Jaun; Rudolf K Thauer; Jeffrey Harmer; Dariush Hinderberger
Two sub-states of the red2 state of methyl-coenzyme M reductase revealed by high-field EPR spectroscopy.
Journal of biological inorganic chemistry : JBIC : a publication of the Society of Biological Inorganic Chemistry 2007;12(8):1097-105.
2007: Zrinka Gattin; Alice Glättli; Bernhard Jaun; Wilfred F van Gunsteren
Simulation of beta-depsipeptides: the effect of missing hydrogen-bond donors on their folding equilibria.
Biopolymers 2007;85(4):318-32.
2007: Thomas Gottschalk; Bernhard Jaun; François Diederich
Container molecules with portals: Reversibly switchable cycloalkane complexation.
Angewandte Chemie (International ed. in English) 2007;46(1-2):260-4.
2006: Daniel Trzesniak; Bernhard Jaun; Raveendra I Mathad; Wilfred F van Gunsteren
Simulation of an all-beta 3-icosapeptide containing the 20 proteinogenic side chains: effect of temperature, pH, counterions, solvent, and force field on helix stability.
Biopolymers 2006;83(6):636-45.
2006: Dariush Hinderberger; Rafal Piskorski; Meike Goenrich; Rudolf K Thauer; Arthur Schweiger; Jeffrey Harmer; Bernhard Jaun
A nickel-alkyl bond in an inactivated state of the enzyme catalyzing methane formation.
Angewandte Chemie (International ed. in English) 2006;45(22):3602-7.
2005: Jeffrey Harmer; Cinzia Finazzo; Rafal Piskorski; Carsten Bauer; Bernhard Jaun; Evert C Duin; Meike Goenrich; Rudolf K Thauer; Sabine Van Doorslaer; Arthur Schweiger
Spin density and coenzyme M coordination geometry of the ox1 form of methyl-coenzyme M reductase: a pulse EPR study.
Journal of the American Chemical Society 2005;127(50):17744-55.
2005: Alice Glättli; Xavier Daura; Pascal Bindschädler; Bernhard Jaun; Yogesh Mahajan; Raveendra I Mathad; Magnus Rueping; Dieter Seebach; Wilfred F van Gunsteren
On the influence of charged side chains on the folding-unfolding equilibrium of beta-peptides: a molecular dynamics simulation study.
Chemistry (Weinheim an der Bergstrasse, Germany) 2005;11(24):7276-93.
2005: Daniel Trzesniak; Alice Glättli; Bernhard Jaun; Wilfred F van Gunsteren
Interpreting NMR data for beta-peptides using molecular dynamics simulations.
Journal of the American Chemical Society 2005;127(41):14320-9.
2005: Jacob E Shokes; Evert C Duin; Carsten Bauer; Bernhard Jaun; Reiner Hedderich; Jürgen Koch; Robert A Scott
Direct interaction of coenzyme M with the active-site Fe-S cluster of heterodisulfide reductase.
FEBS letters 2005;579(7):1741-4.
2004: Bo Han; Bernhard Jaun; Ramanarayanan Krishnamurthy; Albert Eschenmoser
Mannich-type C-nucleosidations in the 5,8-diaza-7,9-dicarba-purine family.
Organic letters 2004;6(21):3691-4.
2004: Meike Goenrich; Felix Mahlert; Evert C Duin; Carsten Bauer; Bernhard Jaun; Rudolf K Thauer
Probing the reactivity of Ni in the active site of methyl-coenzyme M reductase with substrate analogues.
Journal of biological inorganic chemistry : JBIC : a publication of the Society of Biological Inorganic Chemistry 2004;9(6):691-705.
2004: Evert C Duin; Luca Signor; Rafal Piskorski; Felix Mahlert; Michael D Clay; Meike Goenrich; Rudolf K Thauer; Bernhard Jaun; Michael K Johnson
Spectroscopic investigation of the nickel-containing porphinoid cofactor F(430). Comparison of the free cofactor in the (+)1, (+)2 and (+)3 oxidation states with the cofactor bound to methyl-coenzyme M reductase in the silent, red and ox forms.
Journal of biological inorganic chemistry : JBIC : a publication of the Society of Biological Inorganic Chemistry 2004;9(5):563-76.
2004: Audrey Auffrant; Bernhard Jaun; Peter Jarowski; Kendall N Houk; François Diederich
Peralkynylated buta-1,2,3-trienes: exceptionally low rotational barriers of cumulenic C=C bonds in the range of those of peptide C--N bonds.
Chemistry (Weinheim an der Bergstrasse, Germany) 2004;10(12):2906-11.
2004: Magnus Rueping; Yogesh Mahajan; Bernhard Jaun; Dieter Seebach
Design, synthesis and structural investigations of a beta-peptide forming a 314-helix stabilized by electrostatic interactions.
Chemistry (Weinheim an der Bergstrasse, Germany) 2004;10(7):1607-15.
2003: Christine Peter; Magnus Rueping; Hans Jakob Wörner; Bernhard Jaun; Dieter Seebach; Wilfred F van Gunsteren
Molecular dynamics simulations of small peptides: can one derive conformational preferences from ROESY spectra?
Chemistry (Weinheim an der Bergstrasse, Germany) 2003;9(23):5838-49.
2003: Rafal Piskorski; Bernhard Jaun
Direct determination of the number of electrons needed to reduce coenzyme F430 pentamethyl ester to the Ni(I) species exhibiting the electron paramagnetic resonance and ultraviolet-visible spectra characteristic for the MCR(red1) state of methyl-coenzyme M reductase.
Journal of the American Chemical Society 2003;125(43):13120-5.
2003: Bo Han; Zhijun Wang; Bernhard Jaun; Ramanarayanan Krishnamurthy; Albert Eschenmoser
C-Nucleosidations with 2,6-diamino-5,8-diaza-7,9-dicarba-purine.
Organic letters 2003;5(12):2071-4.
2003: Cinzia Finazzo; Jeffrey Harmer; Bernhard Jaun; Evert C Duin; Felix Mahlert; Rudolf K Thauer; Sabine Van Doorslaer; Arthur Schweiger
Characterization of the MCRred2 form of methyl-coenzyme M reductase: a pulse EPR and ENDOR study.
Journal of biological inorganic chemistry : JBIC : a publication of the Society of Biological Inorganic Chemistry 2003;8(5):586-93.
2003: Cinzia Finazzo; Jeffrey Harmer; Carsten Bauer; Bernhard Jaun; Evert C Duin; Felix Mahlert; Meike Goenrich; Rudolf K Thauer; Sabine Van Doorslaer; Arthur Schweiger
Coenzyme B induced coordination of coenzyme M via its thiol group to Ni(I) of F430 in active methyl-coenzyme M reductase.
Journal of the American Chemical Society 2003;125(17):4988-9.
2003: Karl Gademann; Andreas Häne; Magnus Rueping; Bernhard Jaun; Dieter Seebach
The fourth helical secondary structure of beta-peptides: the (P)-28-helix of a beta-hexapeptide consisting of (2R,3S)-3-amino-2-hydroxy acid residues.
Angewandte Chemie (International ed. in English) 2003;42(13):1534-7.
2003: Evert C Duin; Carsten Bauer; Bernhard Jaun; Reiner Hedderich
Coenzyme M binds to a [4Fe-4S] cluster in the active site of heterodisulfide reductase as deduced from EPR studies with the [33S]coenzyme M-treated enzyme.
FEBS letters 2003;538(1-3):81-4.
2002: Andreas Aemissegger; Bernhard Jaun; Donald Hilvert
Investigation of the enzymatic and nonenzymatic cope rearrangement of carbaprephenate to carbachorismate.
The Journal of organic chemistry 2002;67(19):6725-30.
2002: Dieter Seebach; Yogesh Mahajan; Ramanathan Senthilkumar; Magnus Rueping; Bernhard Jaun
Beta-depsipeptides--the effect of a missing and a weakened hydrogen bond on the stability of the beta-peptidic 3(14)-helix.
Chemical communications (Cambridge, England) 2002;(15):1598-9.
2002: Felix Mahlert; Carsten Bauer; Bernhard Jaun; Rudolf K Thauer; Evert C Duin
The nickel enzyme methyl-coenzyme M reductase from methanogenic archaea: In vitro induction of the nickel-based MCR-ox EPR signals from MCR-red2.
Journal of biological inorganic chemistry : JBIC : a publication of the Society of Biological Inorganic Chemistry 2002;7(4-5):500-13.
2002: Dieter Seebach; Meinrad Brenner; Magnus Rueping; Bernhard Jaun
Gamma2-, gamma3-, and gamma(2,3,4)-amino acids, coupling to gamma-hexapeptides: CD spectra, NMR solution and X-ray crystal structures of gamma-peptides.
Chemistry (Weinheim an der Bergstrasse, Germany) 2002;8(3):573-84.
2002: Sergey Ilin; Irene Schlönvogt; Marc-Olivier Ebert; Bernhard Jaun; Harald Schwalbe
Comparison of the NMR spectroscopy solution structures of pyranosyl-rNA and its nucleo-delta-peptide analogue.
Chembiochem : a European journal of chemical biology 2002;3(1):93-9.
2001: Ronald Micura; W Pils; Claudia Hoebartner; K Grubmayr; Marc-Olivier Ebert; Bernhard Jaun
Methylation of the nucleobases in RNA oligonucleotides mediates duplex-hairpin conversion.
Nucleic acids research 2001;29(19):3997-4005.
2001: Ronald Micura; W Pils; K Grubmayr; Marc-Olivier Ebert; Bernhard Jaun
Bridged cyclic oligoribonucleotides--towards models for codon-anticodon pairing.
Nucleosides, nucleotides & nucleic acids 2001;20(4-7):1287-9.
2001: Xavier Daura; Karl Gademann; H Schäfer; Bernhard Jaun; Dieter Seebach; Wilfred F van Gunsteren
The beta-peptide hairpin in solution: conformational study of a beta-hexapeptide in methanol by NMR spectroscopy and MD simulation.
Journal of the American Chemical Society 2001;123(10):2393-404.
2000: Luca Signor; C Knuppe; R Hug; B Schweizer; A Pfaltz; Bernhard Jaun
Methane formation by reaction of a methyl thioether with a photo-excited nickel thiolate--a process mimicking methanogenesis in archaea.
Chemistry (Weinheim an der Bergstrasse, Germany) 2000;6(19):3508-16.
1998: Xavier Daura; Bernhard Jaun; Dieter Seebach; W F van Gunsteren; Alan E Mark
Reversible peptide folding in solution by molecular dynamics simulation.
Journal of molecular biology 1998;280(5):925-32.