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1

Frontispiece: Freezing the Dynamic Gap for Selectivity: Motion-Based Design of Inhibitors of the Shikimate Kinase Enzyme

Prado, Verónica, Lence, Emilio, Thompson, Paul, Hawkins, Alastair R., González-Bello, Concepción

Journal:

Chemistry - A European Journal

Year:

2016

File:

PDF, 2.46 MB

2016

2

QM/MM simulations identify the determinants of catalytic activity differences between type II dehydroquinase enzymes

Lence, Emilio, van der Kamp, Marc W., González-Bello, Concepción, Mulholland, Adrian J.

Journal:

Organic & Biomolecular Chemistry

Year:

2018

Language:

english

File:

PDF, 3.96 MB

english, 2018

3

Photogeneration of Quinone-Methides as Latent Electrophiles for Lysine-Targeting

Perez-Ruiz, Raul, Molins-Molina, Oscar, Lence, Emilio, González-Bello, Concepción, Miranda, Miguel A, Jiménez, M. Consuelo

Journal:

Journal of Organic Chemistry

Year:

2018

Language:

english

File:

PDF, 1.34 MB

english, 2018

4

Synthesis of Rigidified Shikimic Acid Derivatives by Ring-Closing Metathesis to Imprint Inhibitor Efficacy against Shikimate Kinase Enzyme

Pernas, Marina, Blanco, Beatriz, Lence, Emilio, Thompson, Paul, Hawkins, Alastair R, Gonzalez-Bello, Concepcion

Journal:

Organic Chemistry Frontiers

Year:

2019

Language:

english

File:

PDF, 600 KB

english, 2019

5

Self-Immolation of a Bacterial Dehydratase Enzyme by its Epoxide Product

Lence, Emilio, Maneiro, MarÃa, Sanz-Gaitero, Marta, van Raaij, MarK J., Thompson, Paul, Hawkins, Alastair R., Gonzalez-Bello, Concepcion

Journal:

Chemistry - A European Journal

Year:

2020

File:

PDF, 1.68 MB

2020

6

Mechanistic insight into the reaction catalysed by bacterial type II dehydroquinases 1

Coderch, Claire, Lence, Emilio, Peón, Antonio, Lamb, Heather, Hawkins, Alastair R., Gago, Federico, González‑Bello, Concepción

Journal:

Biochemical Journal

Year:

2014

Language:

english

File:

PDF, 2.96 MB

english, 2014

7

Insights into substrate binding and catalysis in bacterial type I dehydroquinase

Maneiro, María, Peón, Antonio, Lence, Emilio, Otero, José M., Van Raaij, Mark J., Thompson, Paul, Hawkins, Alastair R., González‑Bello, Concepción

Journal:

Biochemical Journal

Year:

2014

Language:

english

File:

PDF, 1.52 MB

english, 2014

8

Hydroxylammonium derivatives for selective active-site lysine modification in the anti-virulence bacterial target DHQ1 enzyme

Maneiro, María, Lence, Emilio, Sanz-Gaitero, Marta, Otero, José M., van Raaij, Mark J., Thompson, Paul, Hawkins, Alastair R., González-Bello, Concepción

Journal:

Organic Chemistry Frontiers

Year:

2019

File:

PDF, 3.42 MB

2019

9

Molecular and biochemical insights into the in vivo evolution of AmpC-mediated resistance to ceftolozane/tazobactam during treatment of an MDR Pseudomonas aeruginosa infection

Arca-SuÃ¡rez, Jorge, VÃ¡zquez-Ucha, Juan Carlos, Fraile-Ribot, Pablo Arturo, Lence, Emilio, Cabot, Gabriel, MartÃnez-GuitiÃ¡n, Marta, Lasarte-Monterrubio, Cristina, RodrÃguez-Iglesias, Manuel, Becei

Journal:

Journal of Antimicrobial Chemotherapy

Year:

2020

File:

PDF, 600 KB

2020

10

Protein Binding of Lapatinib and Its N- and O-Dealkylated Metabolites Interrogated by Fluorescence, Ultrafast Spectroscopy and Molecular Dynamics Simulations

Andreu, Inmaculada, Lence, Emilio, GonzÃ¡lez-Bello, ConcepciÃ³n, Mayorga, Cristobalina, Cuquerella, M. Consuelo, VayÃ¡, Ignacio, Miranda, Miguel A.

Journal:

Frontiers in Pharmacology

Year:

2020

File:

PDF, 2.29 MB

2020

11

A Novel Pathway of Protein Haptenation by ß-Lactams

Jiménez, M. Consuelo, Pérez-Ruiz, Raúl, Lence, Emilio, Andreu, Inmaculada, González-Bello, Concepción, Miranda, Miguel A., Limones-Herrero, Daniel

Journal:

Chemistry - A European Journal

Year:

2017

Language:

english

File:

PDF, 2.02 MB

english, 2017

12

Mild, Aprotic Synthesis of 1,2-Diacetals.

Emilio Lence, Luis Castedo, Concepcion Gonzalez

Journal:

Year:

2003

File:

PDF, 111 KB

2003

13

Irreversible covalent modification of type I dehydroquinase with a stable Schiff base

Tizón, Lorena, Maneiro, María, Peón, Antonio, Otero, José M., Lence, Emilio, Poza, Sergio, van Raaij, Mark J., Thompson, Paul, Hawkins, Alastair R., González-Bello, Concepción

Journal:

Organic & Biomolecular Chemistry

Year:

2015

Language:

english

File:

PDF, 1.97 MB

english, 2015

14

Chemical Modification of a Dehydratase Enzyme Involved in Bacterial Virulence by an Ammonium Derivative: Evidence of its Active Site Covalent Adduct

González-Bello, Concepción, Tizón, Lorena, Lence, Emilio, Otero, José M., van Raaij, Mark J., Martinez-Guitian, Marta, Beceiro, Alejandro, Thompson, Paul, Hawkins, Alastair R.

Journal:

Journal of the American Chemical Society

Year:

2015

Language:

english

File:

PDF, 1.24 MB

english, 2015

15

Challenging antimicrobial susceptibility and evolution of resistance (OXA-681) during treatment of a Pseudomonas aeruginosa ST175 clone long-term nosocomial infection

Arca-Suárez, Jorge, Fraile-Ribot, Pablo, Vázquez-Ucha, Juan Carlos, Cabot, Gabriel, Martínez-Guitián, Marta, Lence, Emilio, González-Bello, Concepción, Beceiro, Alejandro, Rodríguez-Iglesias, Manuel,

Journal:

Antimicrobial Agents and Chemotherapy

Year:

2019

Language:

english

File:

PDF, 573 KB

english, 2019

16

Investigation of metabolite-protein interactions by transient absorption spectroscopy and in silico methods

Limones-Herrero, Daniel, Palumbo, Fabrizio, Vendrell-Criado, Victoria, Andreu, Inmaculada, Lence, Emilio, González-Bello, Concepción, Miranda, Miguel A., Jiménez, M. Consuelo

Journal:

Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy

Year:

2020

File:

PDF, 1.99 MB

2020

17

Cover Feature: SelfâImmolation of a Bacterial Dehydratase Enzyme by its Epoxide Product (Chem. Eur. J. 36/2020)

Lence, Emilio, Maneiro, MarÃa, SanzâGaitero, Marta, Raaij, Mark J., Thompson, Paul, Hawkins, Alastair R., GonzÃ¡lezâBello, ConcepciÃ³n

Journal:

Chemistry (Weinheim an der Bergstrasse, Germany)

Year:

2020

File:

PDF, 888 KB

2020

18

Metal-Assisted Ring-Closing/Opening Process of a Chiral Tetrahydroquinazoline

García-Deibe, Ana M., Sanmartín-Matalobos, Jesús, González-Bello, Concepción, Lence, Emilio, Portela-García, Cristina, Martínez-Rodríguez, Luis, Fondo, Matilde

Journal:

Inorganic Chemistry

Year:

2012

Language:

english

File:

PDF, 4.94 MB

english, 2012

19

Freezing the Dynamic Gap for Selectivity: Motion-Based Design of Inhibitors of the Shikimate Kinase Enzyme

Prado, Verónica, Lence, Emilio, Thompson, Paul, Hawkins, Alastair R., González-Bello, Concepción

Journal:

Chemistry - A European Journal

Year:

2016

Language:

english

File:

PDF, 11.19 MB

english, 2016

20

Photobinding of Triflusal to Human Serum Albumin Investigated by Fluorescence, Proteomic Analysis, and Computational Studies

Molins-Molina, Oscar, Pérez-Ruiz, Raúl, Lence, Emilio, González-Bello, Concepción, Miranda, Miguel A., Jiménez, M. Consuelo

Journal:

Frontiers in Pharmacology

Year:

2019

Language:

english

File:

PDF, 2.52 MB

english, 2019

21

Mechanistic Basis of the Inhibition of Type II Dehydroquinase by (2 S )- and (2 R )-2-Benzyl-3-dehydroquinic Acids

Lence, Emilio, Tizón, Lorena, Otero, José M., Peón, Antonio, Prazeres, Verónica F. V., Llamas-Saiz, Antonio L., Fox, Gavin C., van Raaij, Mark J., Lamb, Heather, Hawkins, Alastair R., González-Bello,

Journal:

ACS Chemical Biology

Year:

2013

Language:

english

File:

PDF, 3.61 MB

english, 2013

22

The conformational rigidity of butane-1,2-diacetals as a powerful synthetic tool

Lence, Emilio, Castedo, Luis, González-Bello, Concepción

Journal:

Chemical Society Reviews

Year:

2008

Language:

english

File:

PDF, 1.08 MB

english, 2008

23

Characterization of the locally excited and chargeâtransfer states of the anticancer drug lapatinib by ultrafast spectroscopy and computational studies

VayÃ¡, Ignacio, Andreu, Inmaculada, Lence, Emilio, GonzÃ¡lez-Bello, ConcepciÃ³n, Cuquerella, M. Consuelo, Navarrete-Miguel, Miriam, Roca-SanjuÃ¡n, Daniel, Miranda, Miguel A.

Journal:

Chemistry (Weinheim an der Bergstrasse, Germany)

Year:

2020

File:

PDF, 1.43 MB

2020

24

A selective resin for trans-diequatorial-1,2-diols

Emilio Lence, Luis Castedo, Concepción González-Bello

Journal:

Tetrahedron Letters

Year:

2009

Language:

english

File:

PDF, 560 KB

english, 2009

25

Mycobacterium tuberculosis Shikimate Kinase Inhibitors: Design and Simulation Studies of the Catalytic Turnover

Blanco, Beatriz, Prado, Verónica, Lence, Emilio, Otero, José M., Garcia-Doval, Carmela, van Raaij, Mark J., Llamas-Saiz, Antonio L., Lamb, Heather, Hawkins, Alastair R., González-Bello, Concepción

Journal:

Journal of the American Chemical Society

Year:

2013

Language:

english

File:

PDF, 1.49 MB

english, 2013

26

Study of the Phosphoryl-Transfer Mechanism of Shikimate Kinase by NMR Spectroscopy

Prado, Verónica, Lence, Emilio, Vallejo, Juan A., Beceiro, Alejandro, Thompson, Paul, Hawkins, Alastair R., González-Bello, Concepción

Journal:

Chemistry - A European Journal

Year:

2016

Language:

english

File:

PDF, 5.71 MB

english, 2016

27

Parallel Solid-Phase Synthesis and Evaluation of Inhibitors of Streptomyces c oelicolor Type II Dehydroquinase

González-Bello, Concepción, Lence, Emilio, Toscano, Miguel D., Castedo, Luis, Coggins, John R., Abell, Chris

Journal:

Journal of Medicinal Chemistry

Year:

2003

Language:

english

File:

PDF, 331 KB

english, 2003

28

Targeting the Motion of Shikimate Kinase: Development of Competitive Inhibitors that Stabilize an Inactive Open Conformation of the Enzyme

Prado, Verónica, Lence, Emilio, Maneiro, María, Vázquez-Ucha, Juan C., Beceiro, Alejandro, Thompson, Paul, Hawkins, Alastair R., González-Bello, Concepción

Journal:

Journal of Medicinal Chemistry

Year:

2016

Language:

english

File:

PDF, 2.03 MB

english, 2016

29

Mild, aprotic synthesis of 1,2-diacetals

Emilio Lence, Luis Castedo, Concepción González

Journal:

Tetrahedron Letters

Year:

2002

Language:

english

File:

PDF, 126 KB

english, 2002

30

Serendipitous formation of 3-tosyl-1,2,3,4-tetrahydroquinazoline

Sanmartín-Matalobos, Jesus, García-Deibe, Ana M., Briones-Miguéns, Lucía, Lence, Emilio, González-Bello, Concepcion, Portela-García, Cristina, Fondo, Matilde

Journal:

New Journal of Chemistry

Year:

2013

Language:

english

File:

PDF, 2.50 MB

english, 2013

31

Structural variety of zinc and copper complexes based on a 2,3-disubstituted 1,2,3,4-tetrahydroquinazoline ligand

Sanmartín-Matalobos, Jesús, Portela-García, Cristina, Martínez-Rodríguez, Luis, González-Bello, Concepción, Lence, Emilio, García-Deibe, Ana M., Fondo, Matilde

Journal:

Dalton Transactions

Year:

2012

Language:

english

File:

PDF, 1.16 MB

english, 2012

32

Mapping a protein recognition centre with chiral photoactive ligands. An integrated approach combining photophysics, reactivity, proteomics and molecular dynamics simulation studies

Limones-Herrero, Daniel, Pérez-Ruiz, Raúl, Lence, Emilio, González-Bello, Concepción, Miranda, Miguel A., Jiménez, M. Consuelo

Journal:

Chemical Science

Year:

2017

Language:

english

File:

PDF, 1.77 MB

english, 2017

33

Photobinding of Triflusal to Human Serum Albumin Investigated by Fluorescence, Proteomic Analysis, and Computational Studies

Molins-Molina, Oscar, Pérez-Ruiz, Raúl, Lence, Emilio, González-Bello, Concepción, Miranda, Miguel A., Jiménez, M. Consuelo

Journal:

Frontiers in Pharmacology

Year:

2019

File:

PDF, 2.52 MB

2019

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