O-/N-/S-Specificity in Glycosyltransferase Catalysis: From Mechanistic Understanding to Engineering D Teze, J Coines, F Fredslund, KD Dubey, GN Bidart, PD Adams, ... ACS Catalysis 11 (3), 1810-1815, 2021 | 42 | 2021 |
Modeling catalytic reaction mechanisms in glycoside hydrolases J Coines, L Raich, C Rovira Current Opinion in Chemical Biology 53, 183-191, 2019 | 30 | 2019 |
Two distinct catalytic pathways for GH43 xylanolytic enzymes unveiled by X-ray and QM/MM simulations MAB Morais, J Coines, MN Domingues, RAS Pirolla, CCC Tonoli, ... Nature Communications 12 (1), 367, 2021 | 28 | 2021 |
Oxazoline or oxazolinium ion? the protonation state and conformation of the reaction intermediate of chitinase enzymes revisited J Coines, M Alfonso-Prieto, X Biarnés, A Planas, C Rovira Chemistry–A European Journal, 2018 | 28 | 2018 |
A Single Point Mutation Converts GH84 O-GlcNAc Hydrolases into Phosphorylases: Experimental and Theoretical Evidence D Teze, J Coines, L Raich, V Kalichuk, C Solleux, C Tellier, C André-Miral, ... Journal of the American Chemical Society 142 (5), 2120-2124, 2020 | 27 | 2020 |
Cysteine Nucleophiles in Glycosidase Catalysis: Application of a Covalent β‐l‐Arabinofuranosidase Inhibitor NGS McGregor, J Coines, V Borlandelli, S Amaki, M Artola, A Nin‐Hill, ... Angewandte Chemie 133 (11), 5818-5822, 2021 | 26 | 2021 |
Structural and kinetic features of aldehyde dehydrogenase 1A (ALDH1A) subfamily members, cancer stem cell markers active in retinoic acid biosynthesis R Pequerul, J Vera, J Giménez-Dejoz, I Crespo, J Coines, S Porté, ... Archives of biochemistry and biophysics 681, 108256, 2020 | 24 | 2020 |
Computer simulation to rationalize “rational” engineering of glycoside hydrolases and glycosyltransferases J Coines, I Cuxart, D Teze, C Rovira The Journal of Physical Chemistry B 126 (4), 802-812, 2022 | 15 | 2022 |
Conformational itinerary of sucrose during hydrolysis by retaining amylosucrase S Alonso-Gil, J Coines, I André, C Rovira Frontiers in chemistry 7, 269, 2019 | 14 | 2019 |
An atypical interaction explains the high-affinity of a non-hydrolyzable S-linked 1, 6-α-mannanase inhibitor T Belz, Y Jin, J Coines, C Rovira, GJ Davies, SJ Williams Chemical Communications 53 (66), 9238-9241, 2017 | 10 | 2017 |
Enzymatic Hydrolysis of Human Milk Oligosaccharides. The Molecular Mechanism of Bifidobacterium Bifidum Lacto-N-biosidase I Cuxart, J Coines, O Esquivias, M Faijes, A Planas, X Biarnés, C Rovira ACS catalysis 12 (8), 4737-4743, 2022 | 9 | 2022 |
Glucose transport via the pseudomonad porin OprB: implications for the design of Trojan Horse anti-infectives. J Coines, S Acosta-Gutierrez, I Bodrenko, C Rovira, M Ceccarelli Physical Chemistry Chemical Physics, 2019 | 9 | 2019 |
Enzymatic C4‐Epimerization of UDP‐Glucuronic Acid: Precisely Steered Rotation of a Transient 4‐Keto Intermediate for an Inverted Reaction without Decarboxylation AJE Borg, O Esquivias, J Coines, C Rovira, B Nidetzky Angewandte Chemie International Edition 62 (4), e202211937, 2023 | | 2023 |
Mechanistic insights into substrate-assisted catalysis in glycosidases by means of QM/MM molecular dynamics J Coines Lopez-Nieto Universitat de Barcelona, 2021 | | 2021 |