Atomic description of an enzyme reaction dominated by proton tunneling L Masgrau, A Roujeinikova, LO Johannissen, P Hothi, J Basran, ...
Science 312 (5771), 237-241, 2006
394 2006 Retaining glycosyltransferase mechanism studied by QM/MM methods: Lipopolysaccharyl-α-1, 4-galactosyltransferase C transfers α-galactose via an oxocarbenium ion-like transition … H Gomez, I Polyak, W Thiel, JM Lluch, L Masgrau
Journal of the American Chemical Society 134 (10), 4743-4752, 2012
112 2012 Hydrogen tunnelling in enzyme-catalysed H-transfer reactions: flavoprotein and quinoprotein systems MJ Sutcliffe, L Masgrau, A Roujeinikova, LO Johannissen, P Hothi, ...
Philosophical Transactions of the Royal Society B: Biological Sciences 361 …, 2006
89 2006 Hydrogen tunneling in quinoproteins L Masgrau, J Basran, P Hothi, MJ Sutcliffe, NS Scrutton
Archives of biochemistry and biophysics 428 (1), 41-51, 2004
78 2004 Evolutionary alteration of ALOX15 specificity optimizes the biosynthesis of antiinflammatory and proresolving lipoxins S Adel, F Karst, À González-Lafont, M Pekárová, P Saura, L Masgrau, ...
Proceedings of the National Academy of Sciences 113 (30), E4266-E4275, 2016
64 2016 Natural mutations of the anti-Müllerian hormone type II receptor found in persistent Müllerian duct syndrome affect ligand binding, signal transduction and cellular transport C Belville, JD Maréchal, S Pennetier, P Carmillo, L Masgrau, ...
Human Molecular Genetics 18 (16), 3002-3013, 2009
64 2009 The reactions L Masgrau, A González-Lafont, JM Lluch
The Journal of Chemical Physics 114 (5), 2154-2165, 2001
61 * 2001 Tunneling and classical paths for proton transfer in an enzyme reaction dominated by tunneling: oxidation of tryptamine by aromatic amine dehydrogenase L Masgrau, KE Ranaghan, NS Scrutton, AJ Mulholland, MJ Sutcliffe
The Journal of Physical Chemistry B 111 (11), 3032-3047, 2007
59 2007 Defective AMH signaling disrupts GnRH neuron development and function and contributes to hypogonadotropic hypogonadism SA Malone, GE Papadakis, A Messina, NEH Mimouni, S Trova, ...
eLife 8, 2019
55 2019 The importance of ensemble averaging in enzyme kinetics L Masgrau, DG Truhlar
Accounts of chemical research 48 (2), 431-438, 2015
54 2015 Variational transition-state theory rate constant calculations with multidimensional tunneling corrections of the reaction of acetone with OH L Masgrau, À González-Lafont, JM Lluch
The Journal of Physical Chemistry A 106 (48), 11760-11770, 2002
47 2002 A computational and experimental study of O-glycosylation. Catalysis by human UDP-GalNAc polypeptide: GalNAc transferase-T2 H Gómez, R Rojas, D Patel, LA Tabak, JM Lluch, L Masgrau
Organic & biomolecular chemistry 12 (17), 2645-2655, 2014
45 2014 Substrate-assisted and nucleophilically assisted catalysis in bovine α1, 3-galactosyltransferase. Mechanistic implications for retaining glycosyltransferases H Gómez, JM Lluch, L Masgrau
Journal of the American Chemical Society 135 (18), 7053-7063, 2013
45 2013 Ligand‐induced formation of transient dimers of mammalian 12/15‐lipoxygenase: A key to allosteric behavior of this class of enzymes? I Ivanov, W Shang, L Toledo, L Masgrau, DI Svergun, S Stehling, ...
Proteins: Structure, Function, and Bioinformatics 80 (3), 703-712, 2012
43 2012 Insights into the mechanism of binding of arachidonic acid to mammalian 15-lipoxygenases L Toledo, L Masgrau, JD Marechal, JM Lluch, A Gonzalez-Lafont
The Journal of Physical Chemistry B 114 (20), 7037-7046, 2010
43 2010 Mechanism of the Gas-Phase HO + H2 O → H2 O + OH Reaction and Several Associated Isotope Exchange Reactions: A Canonical Variational Transition State … L Masgrau, A Gonzalez-Lafont, JM Lluch
The Journal of Physical Chemistry A 103 (8), 1044-1053, 1999
42 1999 Analysis of classical and quantum paths for deprotonation of methylamine by methylamine dehydrogenase KE Ranaghan, L Masgrau, NS Scrutton, MJ Sutcliffe, AJ Mulholland
ChemPhysChem 8 (12), 1816-1835, 2007
40 2007 A native ternary complex trapped in a crystal reveals the catalytic mechanism of a retaining glycosyltransferase D Albesa‐Jové, F Mendoza, A Rodrigo‐Unzueta, F Gomollón‐Bel, ...
Angewandte Chemie International Edition 54 (34), 9898-9902, 2015
39 2015 Unraveling how enzymes can use bulky residues to drive site-selective C–H activation: The case of mammalian lipoxygenases catalyzing arachidonic acid oxidation P Saura, R Suardíaz, L Masgrau, JM Lluch, A Gonzalez-Lafont
ACS Catalysis 4 (12), 4351-4363, 2014
38 2014 Variational transition-state theory rate constant calculations of the OH+ CH3SH reaction and several isotopic variants L Masgrau, À González-Lafont, JM Lluch
The Journal of Physical Chemistry A 107 (22), 4490-4496, 2003
37 2003 
Nigel ScruttonProfessor of Enzymology, Manchester Institute of Biotechnology (MIB) and School of ChemistryDirección de correo verificada de manchester.ac.uk
