Access content directly

Krystel El Hage



Image document

Targeting RNA:protein interactions with an integrative approach leads to the identification of potent YBX1 inhibitors

Krystel El Hage , Nicolas Babault , Olek Maciejak , Bénédicte Desforges , Pierrick Craveur
eLife, 2023, 12, pp.e80387. ⟨10.7554/eLife.80387⟩
Journal articles hal-03955052v1

Targeting the Major Groove of the Palindromic d(GGCGCC)2 Sequence by Oligopeptide Derivatives of Anthraquinone Intercalators

Krystel El Hage , Giovanni Ribaudo , Louis Lagardère , Alberto Ongaro , Philippe H. Kahn
Journal of Chemical Information and Modeling, 2022, 62 (24), pp.6649-6666. ⟨10.1021/acs.jcim.2c00337⟩
Journal articles hal-03624169v1
Image document

Lin28, a major translation reprogramming factor, gains access to YB-1-packaged mRNA through its cold-shock domain

Anastasiia Samsonova , Krystel El Hage , Bénédicte Desforges , Vandana Joshi , Marie-Jeanne Clément
Communications Biology, 2021, 4 (1), pp.359. ⟨10.1038/s42003-021-01862-3⟩
Journal articles hal-03176308v1
Image document

The cooperative binding of TDP-43 to GU-rich RNA repeats antagonizes TDP-43 aggregation

Juan Carlos Rengifo-Gonzalez , Krystel El Hage , Marie-Jeanne Clément , Emilie Steiner , Vandana Joshi
eLife, 2021, 10, pp.e.67605. ⟨10.7554/eLife.67605⟩
Journal articles hal-03343496v1
Image document

YB-1 unwinds mRNA secondary structures in vitro and negatively regulates stress granule assembly in HeLa cells

Karina Budkina , Krystel El Hage , Marie-Jeanne Clément , Bénédicte Desforges , Ahmed Bouhss
Nucleic Acids Research, 2021, 49 (17), pp.10061-10081. ⟨10.1093/nar/gkab748⟩
Journal articles hal-03333572v1

Identification of a small molecule splicing inhibitor targeting UHM domains

Asaki Kobayashi , Marie-Jeanne Clément , Pierrick Craveur , Krystel El Hage , Jean Matha Salone
FEBS Journal, 2021, 289 (3), pp.682-698. ⟨10.1111/febs.16199⟩
Journal articles hal-03354012v1

Water Dynamics Around Proteins: T- and R-States of Hemoglobin and Melittin

Marco Pezzella , Krystel El Hage , Michiel Niesen , Sucheol Shin , Adam Willard
Journal of Physical Chemistry B, 2020, 124 (30), pp.6540-6554. ⟨10.1021/acs.jpcb.0c04320⟩
Journal articles hal-02969027v1

Quantum-Chemistry based design of halobenzene derivatives with augmented affinities for the HIV-1 viral G4/C16 base-pair.

Perla El Darazi , Léa El Khoury , Krystel El Hage , Richard G. Maroun , Zeina Hobaika
Frontiers in Chemistry, 2020, 8, pp.440. ⟨10.3389/fchem.2020.00440⟩
Journal articles hal-02377718v1
Image document

Spectrometric and computational studies of the binding of HIV-1 integrase inhibitors to viral DNA extremities

Léa El-Khoury , Krystel El Hage , Jean-Philip Piquemal , Serge Fermandjian , Richard G. Maroun
PeerJ Physical Chemistry, 2019, 1, pp.e6. ⟨10.7717/peerj-pchem.6⟩
Journal articles hal-02372493v1
Image document

A Simple Isomerization of the Purine Scaffold of a Kinase Inhibitor, Roscovitine, Affords a Four- to Seven-Fold Enhancement of Its Affinity for Four CDKs. Could This Be Traced Back to Conjugation-Induced Stiffenings/Loosenings of Rotational Barriers?

Krystel El Hage , Jean-Philip Piquemal , Nassima Oumata , Laurent Meijer , Hervé Galons
ACS Omega, 2017, 2 (7), pp.3467-3474. ⟨10.1021/acsomega.7b00471⟩
Journal articles hal-02126840v1

Impact of Quadrupolar Electrostatics on Atoms Adjacent to the Sigma-Hole in Condensed-Phase Simulations

Krystel El Hage , Tristan Bereau , Sofie Jakobsen , Markus Meuwly
Journal of Chemical Theory and Computation, 2016, 12 (7), pp.3008-3019. ⟨10.1021/acs.jctc.6b00202⟩
Journal articles hal-02160334v1

Extending Halogen-based Medicinal Chemistry to Proteins

Krystel El Hage , Vijay Pandyarajan , Nelson Phillips , Brian Smith , John Menting
Journal of Biological Chemistry, 2016, 291 (53), pp.27023-27041. ⟨10.1074/jbc.M116.761015⟩
Journal articles hal-02160383v1
Image document

Sequential Proton Coupled Electron Transfer (PCET): Dynamics Observed over 8 Orders of Magnitude in Time

Luke Macaleese , Sylvain Hermelin , Krystel El Hage , Pierre Chouzenoux , Alexander Kulesza
Journal of the American Chemical Society, 2016, 138 (13), pp.4401-4407. ⟨10.1021/jacs.5b12587⟩
Journal articles hal-01344620v1

Approaching the double-faceted nature of the CX bond in halobenzenes with a bifunctional probe

Krystel El Hage , Jean-Philip Piquemal , Zeina Hobaika , Richard G. Maroun , Nohad Gresh
Chemical Physics Letters, 2015, 637, pp.51-57. ⟨10.1016/j.cplett.2015.07.047⟩
Journal articles hal-02126856v1

Could the “Janus-like” properties of the halobenzene CX bond (XCl, Br) be leveraged to enhance molecular recognition?

Krystel El Hage , Jean-Philip Piquemal , Zeina Hobaika , Richard G. Maroun , Nohad Gresh
Journal of Computational Chemistry, 2015, 36 (4), pp.210-221. ⟨10.1002/jcc.23786⟩
Journal articles hal-02126858v1

Substituent-Modulated Affinities of Halobenzene Derivatives to the HIV-1 Integrase Recognition Site. Analyses of the Interaction Energies by Parallel Quantum Chemical and Polarizable Molecular Mechanics

Krystel El Hage , Jean-Philip Piquemal , Zeina Hobaika , Richard G. Maroun , Nohad Gresh
Journal of Physical Chemistry A, 2014, 118 (41), pp.9772-9782. ⟨10.1021/jp5079899⟩
Journal articles hal-02126859v1

Polarizable Molecular Mechanics Studies of Cu(I)/Zn(II) Superoxide Dismutase: Bimetallic Binding Site and Structured Waters

Nohad Gresh , Krystel El Hage , David Perahia , Jean-Philip Piquemal , C. Berthomieu
Journal of Computational Chemistry, 2014, 35 (29), pp.2096-2106. ⟨10.1002/jcc.23724⟩
Journal articles hal-01081843v1

Could an anisotropic molecular mechanics/dynamics potential account for sigma hole effects in the complexes of halogenated compounds?

Krystel El Hage , Jean-Philip Piquemal , Zeina Hobaika , Richard G. Maroun , Nohad Gresh
Journal of Computational Chemistry, 2013, 34 (13), pp.1125-1135. ⟨10.1002/jcc.23242⟩
Journal articles hal-02126864v1