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Publications
2026
Correction: The structural landscape and diversity of Pyricularia oryzae MAX effectors revisited
Lahfa M, Barthe P, deGuillen K, Cesari S, Raji M, Kroj T, Le Naour-Vernet M, Hoh F, Gladieux P, Roumestand C, Gracy J, Declerck N, Padilla A, PLoS Pathog, 2026
Optimization of the antiviral spectrum of cyclophilin inhibitors targeting respiratory viruses
Softic L, Jimenez-Araya B, Ahnou N, Duval M, Nevers Q, Brillet R, Guichou J-F, Rodriguez C, Bruscella P, Pawlotsky J-M, Fourati S, Ahmed-Belkacem A, Antimicrob Agents Chemother, 2026
Two folds, many faces: The Magnaporthe oryzae MAX effector AVR-Pia targets novel rice HMA domain-containing proteins
Maidment JHR, Saile SC, Bocquet A, Thivolle C, Bourcet L, Planel LF, Gelin M, Kroj T, Padilla A, deGuillen K, Cesari S, PLoS Pathog, 2026
An integrated structural and functional profiling approach uncovers the mechanisms of pregnane X receptor binding and activation by pharmaceutical and environmental compounds
Derosa Q, Carivenc C, Sirounian S, Grimaldi M, Boulahtouf A, Delfosse V, Balaguer P, Bourguet W, Mol Pharmacol, 2026
2025
Targeting bacterial kinases as a strategy to counteract antibiotic resistance
Buffa V, Kowalewski J, Qi G, Deutscher R, Cica M, Richardoz M, Tomaszczyk M, Kramer A, Knapp S, Dunyach-Remy C, Rox K, Guichou JF, Lionne C, Hausch F, Commun Chem, 2025
Fragment-based drug design of a bacterial kinase inhibitor capable of increasing the antibiotic sensitivity of clinical isolates
Kowalewski J, Deutscher R, Richardoz M, Tomaszczyk M, Gelin M, Labesse G, Hausch F, Wright GD, Dunyach-Remy C, Guichou JF, Lionne C, Commun Chem, 2025
An acyclic nucleoside phosphonate effectively blocks the egress of the malaria parasite by inhibiting the synthesis of cyclic GMP
Ali M, Dura R, Guery MA, Colard-Itte E, Cheviet T, Robresco L, Berry L, Lionne C, Lavazec C, Claessens A, Peyrottes S, Wengelnik K, Wein S, Cerdan R, Sci Adv, 2025
Identification and characterization of a nonpeptidic cyclophilin ligand with antiviral activity against feline and porcine alpha-coronaviruses
Delaplace M, Khan M, Huet H, Softic L, Ahnou N, Bigault L, Guichou JF, Ahmed-Belkacem A, Nevers Q, Le Poder S, Vet Res, 2025
Acyclic Nucleoside Phosphonates As Potential Inhibitors Of Plasmodium Falciparum Egress
Cheviet T, Wein S, Lionne C, Badji Y, Venturini N, Cerdan R, Peyrottes S, Chemistry, 2025
Targeting pregnane X receptor with a potent agonist-based PROTAC to delay colon cancer relapse
Bansard L, Laconde G, Delfosse V, Huet T, Ayeul M, Rigal E, Donati Q, Gerbal-Chaloin S, Daujat-Chavanieu M, Brunel L, Legrand B, Chavanieu A, Martin AR, Pannequin J, Bourguet W, Amblard M, Pascussi JM, Oncogenesis, 2025
Zymoseptoria tritici Effectors Structurally Related to Killer Proteins UmV-KP4 and UmV-KP6 Inhibit Fungal Growth, and Define Extended Protein Families in Fungi
deGuillen K, Mammri L, Gracy J, Padilla A, Barthe P, Hoh F, Lahfa M, Rouffet J, Petit-Houdenot Y, Kroj T, Lebrun MH, Mol Plant Pathol, 2025
Picomolar bivalent inhibitors of protein kinase CK2 active against beta-coronavirus replication
Grenier D, Lopez Molina DS, Gelin M, Mularoni A, Guichou JF, Delcros JG, Martinasso C, Yang Y, Ahnou N, Pawlotsky JM, Ahmed-Belkacem A, Krimm I, Eur J Med Chem, 2025
Rational Design and Synthesis of Highly Stable Haloflavanone DNA Methyltransferase Inhibitors Inducing Tumor Suppressor Gene Re-expression in Cancer Cells
Calzaferri F, Daher H, Gilbert J, Yang Y, Tauziet M, Jallet C, Bessin Y, van der Lee A, Arimondo PB, Krimm I, Julien E, Lopez M, J Med Chem, 2025
Binding-Site Switch for Protein Kinase CK2 Inhibitors
Grenier D, Gelin M, Yang Y, Mularoni A, Guichou JF, Delcros JG, Krimm I, ChemMedChem, 2025
A two-in-one expression construct for biophysical and structural studies of the human pregnane X receptor ligand-binding domain, a pharmaceutical and environmental target
Carivenc C, Laconde G, Blanc P, Amblard M, Bourguet W, Delfosse V, Acta Crystallogr F Struct Biol Commun, 2025
APH Inhibitors that Reverse Aminoglycoside Resistance in Enterococcus casseliflavus
Kaplan E, Chaloin L, Guichou JF, Berrou K, Rahimova R, Labesse G, Lionne C, ChemMedChem, 2025
Cryo-EM structure and regulation of human NAD kinase
Praharaj PP, Li Y, Mary C, Soflaee MH, Ryu K, Kim D, Tran DH, Dey T, Tom HJ, Rion H, Gelin M, Lemoff A, Zacharias LG, Patricio JS, Mathews TP, Chen Z, Lionne C, Hoxhaj G, Labesse G, Sci Adv, 2025
Binding-site switch of Protein Kinase CK2 inhibitors
Krimm I, Grenier D, Gelin M, Yang Cbs Cnrs Fr Y, Mularoni A, Guichou JF, Delcros JG, ChemMedChem, 2025
2024
Determining the Relative Affinity of ORPs for Lipid Ligands Using Fluorescence and Thermal Shift Assays
Delfosse V, Drin G, Methods Mol Biol, 2024
Towards the design of ligands of the internal pocket TEADs C-terminal domain
Toulotte F, Coevoet M, Liberelle M, Bailly F, Zagiel B, Gelin M, Allemand F, Fourquet P, Melnyk P, Guichou JF, Cotelle P, Eur J Med Chem, 2024
The flavonoid resokaempferol improves insulin secretion from healthy and dysfunctional pancreatic beta-cells
Gautheron G, Peraldi-Roux S, Vaille J, Belhadj S, Patyra A, Bayle M, Youl E, Omhmmed S, Guyot M, Cros G, Guichou JF, Uzan B, Movassat J, Quignard JF, Neasta J, Oiry C, Br J Pharmacol, 2024
@TOME 3.0: Interfacing Protein Structure Modeling and Ligand Docking
Pons JL, Reys V, Grand F, Moreau V, Gracy J, Exner TE, Labesse G, J Mol Biol, 2024
Detection and Analysis of Short Linear Motif-Based Protein-Protein Interactions with SLiMAn2 Web Server
Mezghrani A, Simon J, Reys V, Labesse G, Methods Mol Biol, 2024
SLiMAn 2.0: meaningful navigation through peptide-protein interaction networks
Reys V, Pons JL, Labesse G, Nucleic Acids Res, 2024
The structural landscape and diversity of Pyricularia oryzae MAX effectors revisited
Lahfa M, Barthe P, deGuillen K, Cesari S, Raji M, Kroj T, Le Naour-Vernet M, Hoh F, Gladieux P, Roumestand C, Gracy J, Declerck N, Padilla A, PLoS Pathog, 2024
Increases in cyclin A/Cdk activity and in PP2A-B55 inhibition by FAM122A are key mitosis-inducing events
Lacroix B, Vigneron S, Labbe JC, Pintard L, Lionne C, Labesse G, Castro A, Lorca T, EMBO J, 2024
Cancer selective cell death induction by a bivalent CK2 inhibitor targeting the ATP site and the allosteric alphaD pocket
Bancet A, Frem R, Jeanneret F, Mularoni A, Bazelle P, Roelants C, Delcros JG, Guichou JF, Pillet C, Coste I, Renno T, Battail C, Cochet C, Lomberget T, Filhol O, Krimm I, iScience, 2024
2023
Development of HC-258, a Covalent Acrylamide TEAD Inhibitor That Reduces Gene Expression and Cell Migration
Fnaiche A, Chan HC, Paquin A, Gonzalez Suarez N, Vu V, Li F, Allali-Hassani A, Cao MA, Szewczyk MM, Bolotokova A, Allemand F, Gelin M, Barsyte-Lovejoy D, Santhakumar V, Vedadi M, Guichou JF, Annabi B, Gagnon A, ACS Med Chem Lett, 2023
wTSA-CRAFT: an open-access web server for rapid analysis of thermal shift assay experiments
Reys V, Kowalewski J, Gelin M, Lionne C, Bioinform Adv, 2023
Development of LM-41 and AF-2112, two flufenamic acid-derived TEAD inhibitors obtained through the replacement of the trifluoromethyl group by aryl rings
Fnaiche A, Melin L, Suarez NG, Paquin A, Vu V, Li F, Allali-Hassani A, Bolotokova A, Allemand F, Gelin M, Cotelle P, Woo S, LaPlante SR, Barsyte-Lovejoy D, Santhakumar V, Vedadi M, Guichou JF, Annabi B, Gagnon A, Bioorg Med Chem Lett, 2023
Adaptive evolution in virulence effectors of the rice blast fungus Pyricularia oryzae
Le Naour-Vernet M, Charriat F, Gracy J, Cros-Arteil S, Ravel S, Veillet F, Meusnier I, Padilla A, Kroj T, Cesari S, Gladieux P, PLoS Pathog, 2023
The novel cyclophilin inhibitor C105SR reduces hepatic ischaemia-reperfusion injury via mitoprotection
Kheyar A, Ahnou N, Ahmed-Belkacem A, Hulin A, Pressiat C, Ghaleh B, Guichou JF, Morin D, Pawlotsky JM, Teixeira-Clerc F, JHEP Rep, 2023
Insight into the role of the Bateman domain at the molecular and physiological levels through engineered IMPDHs
Gedeon A, Ayoub N, Brule S, Raynal B, Karimova G, Gelin M, Mechaly A, Haouz A, Labesse G, Munier-Lehmann H, Protein Sci, 2023
Linkers in fragment-based drug design: an overview of the literature
Grenier D, Audebert S, Preto J, Guichou JF, Krimm I, Expert Opin Drug Discov, 2023
SecretoMyc, a web-based database on mycobacteria secreted proteins and structure-based homology identification using bio-informatics tools
Gracy J, Vallejos-Sanchez K, Cohen-Gonsaud M, Tuberculosis (Edinb), 2023
Cyclophilin A Isomerisation of Septin 2 Mediates Abscission during Cytokinesis
Gorry RL, Brennan K, Lavin PTM, Mazurski T, Mary C, Matallanas D, Guichou JF, Mc Gee MM, Int J Mol Sci, 2023
Small-Molecule Cyclophilin Inhibitors Potently Reduce Platelet Procoagulant Activity
Van Bael J, Vandenbulcke A, Ahmed-Belkacem A, Guichou JF, Pawlotsky JM, Samyn J, Barendrecht AD, Maas C, De Meyer SF, Vanhoorelbeke K, Tersteeg C, Int J Mol Sci, 2023
A Tripartite Complex HIV-1 Tat-Cyclophilin A-Capsid Protein Enables Tat Encapsidation That Is Required for HIV-1 Infectivity
Schatz M, Marty L, Ounadjela C, Tong PBV, Cardace I, Mettling C, Milhiet PE, Costa L, Godefroy C, Pugniere M, Guichou JF, Mesnard JM, Blaise M, Beaumelle B, J Virol, 2023
A Mycobacterium tuberculosis Effector Targets Mitochondrion, Controls Energy Metabolism, and Limits Cytochrome cExit
Martin M, deVisch A, Boudehen YM, Barthe P, Gutierrez C, Turapov O, Aydogan T, Heriaud L, Gracy J, Neyrolles O, Mukamolova GV, Letourneur F, Cohen-Gonsaud M, Microbiol Spectr, 2023
Structural basis of the mycobacterial stress-response RNA polymerase auto-inhibition via oligomerization
Morichaud Z, Trapani S, Vishwakarma RK, Chaloin L, Lionne C, Lai-Kee-Him J, Bron P, Brodolin K, Nat Commun, 2023
2022
Synthesis and structure-activity relationship studies of original cyclic diadenosine derivatives as nanomolar inhibitors of NAD kinase from pathogenic bacteria
Clement DA, Gelin M, Leseigneur C, Huteau V, Mondange L, Pons JL, Dussurget O, Lionne C, Labesse G, Pochet S, Eur J Med Chem, 2022
Structure-based design, synthesis and biological evaluation of a NAD+analogue targeting Pseudomonas aeruginosa NAD kinase
Rahimova R, Nogaret P, Huteau V, Gelin M, Clement DA, Labesse G, Pochet S, Blanc-Potard AB, Lionne C, FEBS J, 2022
Crystal structure of human NADK2 reveals a dimeric organization and active site occlusion by lysine acetylation
Mary C, Soflaee MH, Kesavan R, Gelin M, Brown H, Zacharias G, Mathews TP, Lemoff A, Lionne C, Labesse G, Hoxhaj G, Mol Cell, 2022
A new family of structurally conserved fungal effectors displays epistatic interactions with plant resistance proteins
Lazar N, Mesarich CH, Petit-Houdenot Y, Talbi N, Li de la Sierra-Gallay I, Zelie E, Blondeau K, Gracy J, Ollivier B, Blaise F, Rouxel T, Balesdent MH, Idnurm A, van Tilbeurgh H, Fudal I, PLoS Pathog, 2022
SLiMAn: An Integrative Web Server for Exploring Short Linear Motif-Mediated Interactions in Interactomes
Reys V, Labesse G, J Proteome Res, 2022
Toward the Design of Ligands Selective for the C-Terminal Domain of TEADs
Liberelle M, Toulotte F, Renault N, Gelin M, Allemand F, Melnyk P, Guichou JF, Cotelle P, J Med Chem, 2022
A Histone Deacetylase (HDAC) Inhibitor with Pleiotropic In Vitro Anti-Toxoplasmaand Anti-PlasmodiumActivities Controls Acute and Chronic ToxoplasmaInfection in Mice
Jublot D, Cavailles P, Kamche S, Francisco D, Fontinha D, Prudencio M, Guichou JF, Labesse G, Sereno D, Loeuillet C, Int J Mol Sci, 2022
Structural basis for the allosteric inhibition of UMP kinase from Gram-positive bacteria, a promising antibacterial target
Walter P, Mechaly A, Bous J, Haouz A, England P, Lai-Kee-Him J, Ancelin A, Hoos S, Baron B, Trapani S, Bron P, Labesse G, Munier-Lehmann H, FEBS J, 2022
Structural evolution of the ancient enzyme, dissimilatory sulfite reductase
Colman DR, Labesse G, Swapna GVT, Stefanakis J, Montelione GT, Boyd ES, Royer CA, Proteins, 2022
2021
Structure-Based and Knowledge-Informed Design of B-Raf Inhibitors Devoid of Deleterious PXR Binding
Schneider M, Delfosse V, Gelin M, Grimaldi M, Granell M, Heriaud L, Pons JL, Cohen Gonsaud M, Balaguer P, Bourguet W, Labesse G, J Med Chem, 2021
CRB1-Related Retinal Dystrophies in a Cohort of 50 Patients: A Reappraisal in the Light of Specific Muller Cell and Photoreceptor CRB1Isoforms
Mairot K, Smirnov V, Bocquet B, Labesse G, Arndt C, Defoort-Dhellemmes S, Zanlonghi X, Hamroun D, Denis D, Picot MC, David T, Grunewald O, Pegart M, Huguet H, Roux AF, Kalatzis V, Dhaenens CM, Meunier I, Int J Mol Sci, 2021
Functional analyses of phosphatidylserine/PI(4)P exchangers with diverse lipid species and membrane contexts reveal unanticipated rules on lipid transfer
Ikhlef S, Lipp NF, Delfosse V, Fuggetta N, Bourguet W, Magdeleine M, Drin G, BMC Biol, 2021
Discovery of a cryptic site at the interface 2 of TEAD - Towards a new family of YAP/TAZ-TEAD inhibitors
Sturbaut M, Bailly F, Coevoet M, Sileo P, Pugniere M, Liberelle M, Magnez R, Thuru X, Chartier-Harlin MC, Melnyk P, Gelin M, Allemand F, Guichou JF, Cotelle P, Eur J Med Chem, 2021
Programmable receptors enable bacterial biosensors to detect pathological biomarkers in clinical samples
Chang HJ, Zuniga A, Conejero I, Voyvodic PL, Gracy J, Fajardo-Ruiz E, Cohen-Gonsaud M, Cambray G, Pageaux GP, Meszaros M, Meunier L, Bonnet J, Nat Commun, 2021
Retinitis Punctata Albescens and RLBP1-Allied Phenotypes: Phenotype-Genotype Correlation and Natural History in the Aim of Gene Therapy
Bocquet B, El Alami Trebki H, Roux AF, Labesse G, Brabet P, Arndt C, Zanlonghi X, Defoort-Dhellemmes S, Hamroun D, Boulicot-Seguin C, Lequeux L, Picot MC, Huguet H, Audo I, Dhaenens CM, Kalatzis V, Meunier I, Ophthalmol Sci, 2021
Proteo3Dnet: a web server for the integration of structural information with interactomics data
Postic G, Andreani J, Marcoux J, Reys V, Guerois R, Rey J, Mouton-Barbosa E, Vandenbrouck Y, Cianferani S, Burlet-Schiltz O, Labesse G, Tuffery P, Nucleic Acids Res, 2021
Design, Synthesis and Evaluation of a Series of 1,5-Diaryl-1,2,3-triazole-4-carbohydrazones as Inhibitors of the YAP-TAZ/TEAD Complex
Gibault F, Sturbaut M, Coevoet M, Pugniere M, Burtscher A, Allemand F, Melnyk P, Hong W, Rubin BP, Pobbati AV, Guichou JF, Cotelle P, Bailly F, ChemMedChem, 2021
Exploring the conformational space of a receptor for drug design: An ERalpha case study
Schneider M, Pons JL, Labesse G, J Mol Graph Model, 2021
The study of the determinants controlling Arpp19 phosphatase-inhibitory activity reveals an Arpp19/PP2A-B55 feedback loop
Labbe JC, Vigneron S, Mechali F, Robert P, Roque S, Genoud C, Goguet-Rubio P, Barthe P, Labesse G, Cohen-Gonsaud M, Castro A, Lorca T, Nat Commun, 2021
Mechanistic insights into the synergistic activation of the RXR-PXR heterodimer by endocrine disruptor mixtures
Delfosse V, Huet T, Harrus D, Granell M, Bourguet M, Gardia-Parege C, Chiavarina B, Grimaldi M, Le Mevel S, Blanc P, Huang D, Gruszczyk J, Demeneix B, Cianferani S, Fini JB, Balaguer P, Bourguet W, Proc Natl Acad Sci U S A, 2021
The Dynamic Ion Motive Force Powering the Bacterial Flagellar Motor
Biquet-Bisquert A, Labesse G, Pedaci F, Nord AL, Front Microbiol, 2021
Resolving the activation mechanism of the D99N antiterminator LicT protein
Yang Y, Gracy J, Declerck N, Demene H, J Struct Biol, 2021
A proline rich protein from the gingival seal around teeth exhibits antimicrobial properties against Porphyromonas gingivalis
Fouillen A, Mary C, Ponce KJ, Moffatt P, Nanci A, Sci Rep, 2021
2020
A phenyl pyrrolidine derivative reveals a dual inhibition mechanism of myocardial mitochondrial permeability transition pore, which is limited by its myocardial distribution
Panel M, Ahmed-Belkacem A, Ruiz I, Guichou JF, Pawlotsky JM, Ghaleh B, Morin D, J Pharmacol Exp Ther, 2020
Circulating tumor DNA genomics reveals potential mechanisms of resistance to BRAF-targeted therapies in BRAF-mutant metastatic non-small cell lung cancer patients
Ortiz-Cuaran S, Mezquita L, Swalduz A, Aldea M, Mazieres J, Leonce C, Jovelet C, Pradines A, Avrillon V, Chumbi Flores WR, Lacroix L, Loriot Y, Westeel V, Ngo-Camus M, Tissot C, Raynaud C, Gervais R, Brain E, Monnet I, Giroux Leprieur E, Caramella C, Mahier-Aut Oukhatar C, Hoog-Labouret N, de Kievit F, Howarth K, Morris C, Green E, Friboulet L, Chabaud S, Guichou JF, Perol M, Besse B, Blay JY, Saintigny P, Planchard D, Clin Cancer Res, 2020
Imidazo[1,2-a]quinoxalines for melanoma treatment with original mechanism of action
Patinote C, Deleuze-Masquefa C, Kaddour KH, Vincent LA, Larive R, Zghaib Z, Guichou JF, Assaf MD, Cuq P, Bonnet PA, Eur J Med Chem, 2020
An oligomeric switch controls the Mrr-induced SOS response in E. coli
Bourges AC, Torres Montaguth OE, Tadesse W, Labesse G, Aertsen A, Royer CA, Declerck N, DNA Repair (Amst), 2020
Fragment Linking Strategies for Structure-Based Drug Design
Bancet A, Raingeval C, Lomberget T, Le Borgne M, Guichou JF, Krimm I, J Med Chem, 2020
New Chemical Probe Targeting Bacterial NAD Kinase
Clement DA, Leseigneur C, Gelin M, Coelho D, Huteau V, Lionne C, Labesse G, Dussurget O, Pochet S, Molecules, 2020
[In silico profiling of protein kinases inhibitors]
Reys V, Labesse G, Med Sci (Paris), 2020
Probing Protein Interaction Networks by Combining MS-Based Proteomics and Structural Data Integration
Postic G, Marcoux J, Reys V, Andreani J, Vandenbrouck Y, Bousquet MP, Mouton-Barbosa E, Cianferani S, Burlet-Schiltz O, Guerois R, Labesse G, Tuffery P, J Proteome Res, 2020
From substrate to fragments to inhibitor active in vivo against Staphylococcus aureus
Gelin M, Paoletti J, Nahori MA, Huteau V, Leseigneur C, Jouvion G, Dugue L, Clement D, Pons JL, Assairi L, Pochet S, Labesse G, Dussurget O, ACS Infect Dis, 2020
Structural Insights into of the Allosteric Activation of the LicT Antiterminator by PTS-Mediated Phosphorylation
Yang Y, Padilla A, deGuillen K, Mammri L, Gracy J, Declerck N, Demene H, Structure, 2020
Towards accurate high-throughput ligand affinity prediction by exploiting structural ensembles, docking metrics and ligand similarity
Schneider M, Pons JL, Bourguet W, Labesse G, Bioinformatics, 2020
Structural and Functional Specialization of OSBP-Related Proteins
Delfosse V, Bourguet W, Drin G, Contact, 2020
2019
Insights into the activation mechanism of human estrogen-related receptor gamma by environmental endocrine disruptors
Thouennon E, Delfosse V, Bailly R, Blanc P, Boulahtouf A, Grimaldi M, Barducci A, Bourguet W, Balaguer P, Cell Mol Life Sci, 2019
In silico predictions of endocrine disruptors properties
Schneider M, Pons JL, Labesse G, Bourguet W, Endocrinology, 2019
Small-molecule inhibitors of cyclophilins block opening of the mitochondrial permeability transition pore and protect mice from hepatic ischemia-reperfusion injury
Panel M, Ruiz I, Brillet R, Lafdil F, Teixeira-Clerc F, Nguyen CT, Calderaro J, Gelin M, Allemand F, Guichou JF, Ghaleh B, Ahmed-Belkacem A, Morin D, Pawlotsky JM, Gastroenterology, 2019
The Ellagitannin Metabolite Urolithin C is a Glucose-Dependent Regulator of Insulin Secretion through L-type Calcium Channel Activation
Bayle M, Neasta J, Dall'Asta M, Gautheron G, Virsolvy A, Quignard JF, Youl E, Magous R, Guichou JF, Crozier A, Del Rio D, Cros G, Oiry C, Br J Pharmacol, 2019
Insights into Substrate and Inhibitor Selectivity among Human GLUT Transporters through Comparative Modeling and Molecular Docking
Salgado Ferreira R, Pons JL, Labesse G, ACS Omega, 2019
Novel and selective TLR7 antagonists among the imidazo[1,2-a]pyrazines, imidazo[1,5-a]quinoxalines and pyrazolo[1,5-a]quinoxalines series
Bou Karroum N, Moarbess G, Guichou JF, Bonnet PA, Patinote C, Bouharoun-Tayoun H, Chamat S, Cuq P, Diab-Assaf M, Kassab I, Masquefa C, J Med Chem, 2019
Nonclassical Ligand-Independent Regulation of Go Protein by an Orphan Class C G-Protein-Coupled Receptor
Hajj M, De Vita T, Vol C, Renassia C, Bologna JC, Brabet I, Cazade M, Pastore M, Blahos J, Labesse G, Pin JP, Prezeau L, Mol Pharmacol, 2019
Increase in muscle power is associated with myofibrillar ATPase adaptations during resistance training
Philippe AG, Lionne C, Sanchez AMJ, Pagano AF, Candau R, Exp Physiol, 2019
A Tiny Change Makes a Big Difference in the Anti-Parasitic Activities of an HDAC Inhibitor
Loeuillet C, Touquet B, Guichou JF, Labesse G, Sereno D, Int J Mol Sci, 2019
Characterization of XPR1/SLC53A1 variants located outside of the SPX domain in patients with primary familial brain calcification
Lopez-Sanchez U, Nicolas G, Richard AC, Maltete D, Charif M, Ayrignac X, Goizet C, Touhami J, Labesse G, Battini JL, Sitbon M, Sci Rep, 2019
Molecular Dynamics Simulations of the Allosteric Modulation of the Adenosine A2A Receptor by a Mini-G Protein
Renault P, Louet M, Marie J, Labesse G, Floquet N, Sci Rep, 2019
First-in-class allosteric inhibitors of bacterial IMPDHs
Alexandre T, Lupan A, Helynck O, Vichier-Guerre S, Dugue L, Gelin M, Haouz A, Labesse G, Munier-Lehmann H, Eur J Med Chem, 2019
Structural basis for chemically-induced homodimerization of a single domain antibody
Lesne J, Chang HJ, De Visch A, Paloni M, Barthe P, Guichou JF, Mayonove P, Barducci A, Labesse G, Bonnet J, Cohen-Gonsaud M, Sci Rep, 2019
Mechanisms of endocrine disruption through nuclear receptors and related pathways
Balaguer P, Delfosse V, Bourguet W, Curr Opin Endocr Metab Res, 2019
SHEDding light on the role of Pragmin pseudo-kinases in cancer
Roche S, Lecointre C, Simon V, Labesse G, Am J Cancer Res, 2019
Comprehensive classification of the plant non-specific lipid transfer protein superfamily towards its sequence-structure-function analysis
Fleury C, Gracy J, Gautier MF, Pons JL, Dufayard JF, Labesse G, Ruiz M, de Lamotte F, PeerJ, 2019
2018
Structural determinants of the catalytic mechanism of Plasmodium CCT, a key enzyme of malaria lipid biosynthesis
Guca E, Nagy GN, Hajdu F, Marton L, Izrael R, Hoh F, Yang Y, Vial H, Vertessy BG, Guichou JF, Cerdan R, Sci Rep, 2018
Characterization of the anti-hepatitis C virus activity of new non-peptidic small-molecule cyclophilin inhibitors with a potential for broad anti-
Nevers Q, Ruiz I, Ahnou N, Donati F, Brillet R, Softic L, Chazal M, Jouvenet N, Fourati S, Baudesson C, Bruscella P, Gelin M, Guichou JF, Pawlotsky JM, Ahmed-Belkacem A, Antimicrob Agents Chemother, 2018
An engineered device for indoleacetic acid production under quorum sensing signals enables Cupriavidus pinatubonensis JMP134 to stimulate plant growth
Zuniga A, De la Fuente F, Federici F, Lionne C, Bonnet J, de Lorenzo V, Gonzalez B, ACS Synth Biol, 2018
Toward the Discovery of a Novel Class of YAPaTEAD Interaction Inhibitors by Virtual Screening Approach Targeting YAPaTEAD ProteinaProtein Interface
Gibault F, Coevoet M, Sturbaut M, Farce A, Renault N, Allemand F, Guichou JF, Drucbert AS, Foulon C, Magnez R, Thuru X, Corvaisier M, Huet G, Chavatte P, Melnyk P, Bailly F, Cotelle P, Cancers (Basel), 2018
Dimerization of the Pragmin Pseudo-Kinase Regulates Protein Tyrosine Phosphorylation
Lecointre C, Simon V, Kerneur C, Allemand F, Fournet A, Montarras I, Pons JL, Gelin M, Brignatz C, Urbach S, Labesse G, Roche S, Structure, 2018
Synthesis of aminophenylhydroxamate and aminobenzylhydroxamate derivatives and in vitro screening for antiparasitic and histone deacetylase inhibitory activity
Loeuillet C, Touquet B, Oury B, Eddaikra N, Pons JL, Guichou JF, Labesse G, Sereno D, Int J Parasitol Drugs Drug Resist, 2018
KNOTTIN: the database of inhibitor cystine knot scaffold after 10 years, toward a systematic structure modeling
Postic G, Gracy J, Perin C, Chiche L, Gelly JC, Nucleic Acids Res, 2018
Identification of allosteric inhibitors of the ecto-5'-nucleotidase (CD73) targeting the dimer interface
Rahimova R, Fontanel S, Lionne C, Jordheim LP, Peyrottes S, Chaloin L, PLoS Comput Biol, 2018
2017
Structural and functional evidences for the interactions between nuclear hormone receptors and endocrine disruptors at low doses
Balaguer P, Delfosse V, Grimaldi M, Bourguet W, C R Biol, 2017
Correction for Vigneron et al., "Characterization of the Mechanisms Controlling Greatwall Activity"
Vigneron S, Gharbi-Ayachi A, Raymond AA, Burgess A, Labbe JC, Labesse G, Monsarrat B, Lorca T, Castro A, Mol Cell Biol, 2017
Are there two different binding sites for ATP on the myosin head, or only one that switches between two conformers?
Tesi C, Barman T, Lionne C, J Muscle Res Cell Motil, 2017
Recognition of the Magnaporthe oryzae effector AVR-Pia by the decoy domain of the rice NLR immune receptor RGA5
Ortiz D, deGuillen K, Cesari S, Chalvon V, Gracy J, Padilla A, Kroj T, Plant Cell, 2017
2016
8-Thioalkyl-adenosine derivatives inhibit Listeria monocytogenes NAD kinase through a novel binding mode
Paoletti J, Assairi L, Gelin M, Huteau V, Nahori MA, Dussurget O, Labesse G, Pochet S, Eur J Med Chem, 2016
Fragment-based discovery of a new family of non-peptidic small-molecule cyclophilin inhibitors with potent antiviral activities
Ahmed-Belkacem A, Colliandre L, Ahnou N, Nevers Q, Gelin M, Bessin Y, Brillet R, Cala O, Douguet D, Bourguet W, Krimm I, Pawlotsky JM, Guichou JF, Nat Commun, 2016
A new autosomal dominant eye and lung syndrome linked to mutations in TIMP3 gene
Meunier I, Bocquet B, Labesse G, Zeitz C, Defoort-Dhellemmes S, Lacroux A, Mauget-Faysse M, Drumare I, Gamez AS, Mathieu C, Marquette V, Sagot L, Dhaenens CM, Arndt C, Carroll P, Remy-Jardin M, Cohen SY, Sahel JA, Puech B, Audo I, Mrejen S, Hamel CP, Sci Rep, 2016
Nuclear Envelope Protein SUN2 Promotes Cyclophilin-A-Dependent Steps of HIV Replication
Lahaye X, Satoh T, Gentili M, Cerboni S, Silvin A, Conrad C, Ahmed-Belkacem A, Rodriguez EC, Guichou JF, Bosquet N, Piel M, Le Grand R, King MC, Pawlotsky JM, Manel N, Cell Rep, 2016
[The association makes the poison: new perspective on the cocktail effect of xenobiotics and drug interactions]
Delfosse V, Balaguer P, Bourguet W, Med Sci (Paris), 2016
New imidazoquinoxaline derivatives: Synthesis, biological evaluation on melanoma, effect on tubulin polymerization and structure-activity relationships
Zghaib Z, Guichou JF, Vappiani J, Bec N, Hadj-Kaddour K, Vincent LA, Paniagua-Gayraud S, Larroque C, Moarbess G, Cuq P, Kassab I, Deleuze-Masquefa C, Diab-Assaf M, Bonnet PA, Bioorg Med Chem, 2016
New IKK inhibitors: Synthesis of new imidazo[1,2-a]quinoxaline derivatives using microwave assistance and biological evaluation as IKK inhibitors
Moarbess G, Guichou JF, Paniagua-Gayraud S, Chouchou A, Marcadet O, Leroy F, Ruedas R, Cuq P, Deleuze-Masquefa C, Bonnet PA, Eur J Med Chem, 2016
Aminoglycoside binding and catalysis specificity of aminoglycoside 2a-phosphotransferase IVa: A thermodynamic, structural and kinetic study
Kaplan E, Guichou JF, Chaloin L, Kunzelmann S, Leban N, Serpersu EH, Lionne C, Biochim Biophys Acta, 2016
A dominant mutation in MAPKAPK3, an actor of p38 signaling pathway, causes a new retinal dystrophy involving Bruch's membrane and retinal pigment epithelium
Meunier I, Lenaers G, Bocquet B, Baudoin C, Piro-Megy C, Cubizolle A, Quiles M, Jean-Charles A, Cohen SY, Merle H, Gaudric A, Labesse G, Manes G, Pequignot M, Cazevieille C, Dhaenens CM, Fichard A, Ronkina N, Arthur SJ, Gaestel M, Hamel CP, Hum Mol Genet, 2016
2015
Structure Analysis Uncovers a Highly Diverse but Structurally Conserved Effector Family in Phytopathogenic Fungi
deGuillen K, Ortiz-Vallejo D, Gracy J, Fournier E, Kroj T, Padilla A, PLoS Pathog, 2015
Synergistic activation of human pregnane X receptor by binary cocktails of pharmaceutical and environmental compounds
Delfosse V, Dendele B, Huet T, Grimaldi M, Boulahtouf A, Gerbal-Chaloin S, Beucher B, Roecklin D, Muller C, Rahmani R, Cavailles V, Daujat-Chavanieu M, Vivat V, Pascussi JM, Balaguer P, Bourguet W, Nat Commun, 2015
Crystallographic studies of two variants of Pseudomonas aeruginosa IMPDH with impaired allosteric regulation
Labesse G, Alexandre T, Gelin M, Haouz A, Munier-Lehmann H, Acta Crystallogr D Biol Crystallogr, 2015
Combining `dry' co-crystallization and in situ diffraction to facilitate ligand screening by X-ray crystallography
Gelin M, Delfosse V, Allemand F, Hoh F, Sallaz-Damaz Y, Pirocchi M, Bourguet W, Ferrer JL, Labesse G, Guichou JF, Acta Crystallogr D Biol Crystallogr, 2015
Two crystal structures of the FK506-binding domain of Plasmodium falciparum FKBP35 in complex with rapamycin at high resolution
Bianchin A, Allemand F, Bell A, Chubb AJ, Guichou JF, Acta Crystallogr D Biol Crystallogr, 2015
An Unexpected Mode Of Binding Defines BMS948 as A Full Retinoic Acid Receptor beta (RARbeta, NR1B2) Selective Agonist
Nadendla E, Teyssier C, Delfosse V, Vivat V, Krishnasamy G, Gronemeyer H, Bourguet W, Germain P, PLoS ONE, 2015
Reporter Cell Lines for the Characterization of the Interactions between Human Nuclear Receptors and Endocrine Disruptors
Grimaldi M, Boulahtouf A, Delfosse V, Thouennon E, Bourguet W, Balaguer P, Front Endocrinol (Lausanne), 2015
Reporter cell lines to evaluate the selectivity of chemicals for human and zebrafish estrogen and peroxysome proliferator activated gamma receptors
Grimaldi M, Boulahtouf A, Delfosse V, Thouennon E, Bourguet W, Balaguer P, Front Neurosci, 2015
INTRACELLULAR TRANSPORT. Phosphatidylserine transport by ORP/Osh proteins is driven by phosphatidylinositol 4-phosphate
Moser von Filseck J, Copic A, Delfosse V, Vanni S, Jackson CL, Bourguet W, Drin G, Science, 2015
2014
Oleoyl-Coenzyme A Regulates Interaction of Transcriptional Regulator RaaS (Rv1219c) with DNA in Mycobacteria
Turapov O, Waddell SJ, Burke B, Glenn S, Sarybaeva AA, Tudo G, Labesse G, Young DI, Young M, Andrew PW, Butcher PD, Cohen-Gonsaud M, Mukamolova GV, J Biol Chem, 2014
Chromatin Insulator Factors Involved in Long-Range DNA Interactions and Their Role in the Folding of the Drosophila Genome
Vogelmann J, Le Gall A, Dejardin S, Allemand F, Gamot A, Labesse G, Cuvier O, Negre N, Cohen-Gonsaud M, Margeat E, Nollmann M, PLoS Genet, 2014
Antimicrobial treatment improves mycobacterial survival in nonpermissive growth conditions
Turapov O, Waddell SJ, Burke B, Glenn S, Sarybaeva AA, Tudo G, Labesse G, Young DI, Young M, Andrew PW, Butcher PD, Cohen-Gonsaud M, Mukamolova GV, Antimicrob Agents Chemother, 2014
Homodimerization of RBPMS2 through a new RRM-interaction motif is necessary to control smooth muscle plasticity
Sagnol S, Yang Y, Bessin Y, Allemand F, Hapkova I, Notarnicola C, Guichou JF, Faure S, Labesse G, de Santa Barbara P, Nucleic Acids Res, 2014
Stoichiometry of scaffold complexes in living neurons - DLC2 as a dimerization engine for GKAP
Moutin E, Compan V, Raynaud F, Clerte C, Bouquier N, Labesse G, Ferguson ML, Fagni L, Royer CA, Perroy J, J Cell Sci, 2014
Aedesin: Structure and Antimicrobial Activity against Multidrug Resistant Bacterial Strains
Godreuil S, Leban N, Padilla A, Hamel R, Luplertlop N, Chauffour A, Vittecoq M, Hoh F, Thomas F, Sougakoff W, Lionne C, Yssel H, Misse D, PLoS ONE, 2014
Nuclear receptor profiling of bisphenol-a and its halogenated analogues
Delfosse V, Grimaldi M, le Maire A, Bourguet W, Balaguer P, Vitam Horm, 2014
Structural and Functional Profiling of Environmental Ligands for Estrogen Receptors
Delfosse V, Grimaldi M, Cavailles V, Balaguer P, Bourguet W, Environ Health Perspect, 2014
6-(Hetero)Arylpurine nucleotides as inhibitors of the oncogenic target DNPH1: Synthesis, structural studies and cytotoxic activities
Amiable C, Paoletti J, Haouz A, Padilla A, Labesse G, Kaminski PA, Pochet S, Eur J Med Chem, 2014
Inhibition of RNA binding to hepatitis C virus RNA-dependent RNA polymerase: a new mechanism for antiviral intervention
Ahmed-Belkacem A, Guichou JF, Brillet R, Ahnou N, Hernandez E, Pallier C, Pawlotsky JM, Nucleic Acids Res, 2014
Protein-ligand structure guided by backbone and side-chain proton chemical shift perturbations
Aguirre C, Ten Brink T, Cala O, Guichou JF, Krimm I, J Biomol NMR, 2014
Comparing Binding Modes of Analogous Fragments Using NMR in Fragment-Based Drug Design: Application to PRDX5
Aguirre C, Brink TT, Guichou JF, Cala O, Krimm I, PLoS ONE, 2014
A structural perspective on nuclear receptors as targets of environmental compounds
Delfosse V, Maire AL, Balaguer P, Bourguet W, Acta Pharmacol Sin, 2014
2013
Vpr expression abolishes the capacity of HIV-1 infected cells to repair uracilated DNA
Eldin P, Chazal N, Fenard D, Bernard E, Guichou JF, Briant L, Nucleic Acids Res, 2013
Structure of the oncoprotein Rcl bound to three nucleotide analogues
Padilla A, Amiable C, Pochet S, Kaminski PA, Labesse G, Acta Crystallogr D Biol Crystallogr, 2013
Mutations in IMPG1 cause vitelliform macular dystrophies
Manes G, Meunier I, Avila-Fernandez A, Banfi S, Le Meur G, Zanlonghi X, Corton M, Simonelli F, Brabet P, Labesse G, Audo I, Mohand-Said S, Zeitz C, Sahel JA, Weber M, Dollfus H, Dhaenens CM, Allorge D, De Baere E, Koenekoop RK, Kohl S, Cremers FP, Hollyfield JG, Senechal A, Hebrard M, Bocquet B, Ayuso Garcia C, Hamel CP, Am J Hum Genet, 2013
MgATP regulates allostery and fiber formation in IMPDHs
Labesse G, Alexandre T, Vaupre L, Salard-Arnaud I, Him JL, Raynal B, Bron P, Munier-Lehmann H, Structure, 2013
Phosphodeoxyribosyltransferases, designed enzymes for deoxyribonucleotides synthesis
Kaminski PA, Labesse G, J Biol Chem, 2013
[Towards bisphenols without hormonal effects]
Balaguer P, Delfosse V, Grimaldi M, Bourguet W, Med Sci (Paris), 2013
N (6)-Substituted AMPs Inhibit Mammalian Deoxynucleotide N-Hydrolase DNPH1
Amiable C, Pochet S, Padilla A, Labesse G, Kaminski PA, PLoS ONE, 2013
2012
The C-terminal domain of the virulence factor MgtC is a divergent ACT domain.
Yang Y, Labesse G, Carrere-Kremer S, Esteves K, Kremer L, Cohen-Gonsaud M, Blanc-Potard AB, J. Bacteriol., 2012
e-Drug3D: 3D structure collections dedicated to drug repurposing and fragment-based drug design.
Pihan E, Colliandre L, Guichou JF, Douguet D, Bioinformatics, 2012
Screening and in situ synthesis using crystals of a NAD kinase lead to a potent antistaphylococcal compound.
Gelin M, Poncet-Montange G, Assairi L, Morellato L, Huteau V, Dugue L, Dussurget O, Pochet S, Labesse G, Structure, 2012
Fragment and conquer: from structure to complexes to function.
Guichou JF, Labesse G, Structure, 2012
Structural and mechanistic insights into bisphenols action provide guidelines for risk assessment and discovery of bisphenol A substitutes
Delfosse V, Grimaldi M, Pons JL, Boulahtouf A, le Maire A, Cavailles V, Labesse G, Bourguet W, Balaguer P, Proc Natl Acad Sci U S A, 2012
2011
Osh4p exchanges sterols for phosphatidylinositol 4-phosphate between lipid bilayers
de Saint-Jean M, Delfosse V, Douguet D, Chicanne G, Payrastre B, Bourguet W, Antonny B, Drin G, J Cell Biol, 2011
Characterization of the mechanisms controlling Greatwall activity
Vigneron S, Gharbi-Ayachi A, Raymond AA, Burgess A, Labbe JC, Labesse G, Monsarrat B, Lorca T, Castro A, Mol Cell Biol, 2011
Montpellier infectious diseases (MID): 1st annual meeting (2011)
Sitbon M, Biard-Piechaczyk M, Robert V, Briant L, Kohler S, Labesse G, Devaux C, Infect Genet Evol, 2011
Structural and functional characterization of the Mycobacterium tuberculosis uridine monophosphate kinase: insights into the allosteric regulation
Labesse G, Benkali K, Salard-Arnaud I, Gilles AM, Munier-Lehmann H, Nucleic Acids Res, 2011
Interdomain movements in metabotropic glutamate receptor activation
Huang S, Cao J, Jiang M, Labesse G, Liu J, Pin JP, Rondard P, Proc Natl Acad Sci U S A, 2011
Structure and modeling of knottins, a promising molecular scaffold for drug discovery
Gracy J, Chiche L, Curr Pharm Des, 2011
The Leishmania nicotinamidase is essential for NAD+ production and parasite proliferation
Gazanion E, Garcia D, Silvestre R, Gerard C, Guichou JF, Labesse G, Seveno M, Cordeiro-Da-Silva A, Ouaissi A, Sereno D, Vergnes B, Mol Microbiol, 2011
In-plate protein crystallization, in situ ligand soaking and X-ray diffraction
le Maire A, Gelin M, Pochet S, Hoh F, Pirocchi M, Guichou JF, Ferrer JL, Labesse G, Acta Crystallogr D Biol Crystallogr, 2011
2010
2009
ROP2 from Toxoplasma gondii: a virulence factor with a protein-kinase fold and no enzymatic activity
Labesse G, Gelin M, Bessin Y, Lebrun M, Papoin J, Cerdan R, Arold ST, Dubremetz JF, Structure, 2009
Structural characterization of the mammalian deoxynucleotide N-hydrolase Rcl and its stabilizing interactions with two inhibitors
Yang Y, Padilla A, Zhang C, Labesse G, Kaminski PA, J Mol Biol, 2009
@TOME-2: a new pipeline for comparative modeling of protein-ligand complexes
Pons JL, Labesse G, Nucleic Acids Res, 2009
PROKR2 missense mutations associated with Kallmann syndrome impair receptor signalling activity
Monnier C, Dode C, Fabre L, Teixeira L, Labesse G, Pin JP, Hardelin JP, Rondard P, Hum Mol Genet, 2009
Inhibition of 7,8-diaminopelargonic acid aminotransferase from Mycobacterium tuberculosis by chiral and achiral anologs of its substrate: biological implications
Mann S, Colliandre L, Labesse G, Ploux O, Biochimie, 2009
A 20-amino acid module of protein kinase C{epsilon} involved in translocation and selective targeting at cell-cell contacts
Diouf B, Collazos A, Labesse G, Macari F, Choquet A, Clair P, Gauthier-Rouviere C, Guerineau NC, Jay P, Hollande F, Joubert D, J Biol Chem, 2009
2008
Structure-activity relationships of Bak derived peptides: affinity and specificity modulations by amino acid replacement
Frey V, Viaud J, Subra G, Cauquil N, Guichou JF, Casara P, Grassy G, Chavanieu A, Eur J Med Chem, 2008
Structural basis for the interaction between focal adhesion kinase and CD4
Garron ML, Arthos J, Guichou JF, McNally J, Cicala C, Arold ST, J Mol Biol, 2008
Molecular basis for the lack of enantioselectivity of human 3-phosphoglycerate kinase
Gondeau C, Chaloin L, Lallemand P, Roy B, Perigaud C, Barman T, Varga A, Vas M, Lionne C, Arold ST, Nucleic Acids Res, 2008
KNOTTIN: the knottin or inhibitor cystine knot scaffold in 2007
Gracy J, Le-Nguyen D, Gelly JC, Kaas Q, Heitz A, Chiche L, Nucleic Acids Res, 2008
Knottin cyclization: impact on structure and dynamics
Heitz A, Avrutina O, Le-Nguyen D, Diederichsen U, Hernandez JF, Gracy J, Kolmar H, Chiche L, BMC Struct Biol, 2008
Nuclear receptor ligand-binding domains: reduction of helix H12 dynamics to favour crystallization
Nahoum V, Lipski A, Quillard F, Guichou JF, Boublik Y, Perez E, Germain P, de Lera AR, Bourguet W, Acta Crystallogr Sect F Struct Biol Cryst Commun, 2008
Comprehensive 3D-modeling of allergenic proteins and amino acid composition of potential conformational IgE epitopes
Oezguen N, Zhou B, Negi SS, Ivanciuc O, Schein CH, Labesse G, Braun W, Mol Immunol, 2008
Structure and folding of disulfide-rich miniproteins: insights from molecular dynamics simulations and MM-PBSA free energy calculations
Combelles C, Gracy J, Heitz A, Craik DJ, Chiche L, Proteins, 2008
Functioning of the dimeric GABA(B) receptor extracellular domain revealed by glycan wedge scanning
Rondard P, Huang S, Monnier C, Tu H, Blanchard B, Oueslati N, Malhaire F, Li Y, Trinquet E, Labesse G, Pin JP, Liu J, Embo J, 2008
N-1H-benzimidazol-5-ylbenzenesulfonamide derivatives as potent hPXR agonists
Benod C, Subra G, Nahoum V, Mallavialle A, Guichou JF, Milhau J, Robles S, Bourguet W, Pascussi JM, Balaguer P, Chavanieu A, Bioorg Med Chem, 2008
A phospho-sugar binding domain homologous to NagB enzymes regulates the activity of the central glycolytic genes repressor
Doan T, Martin L, Zorrilla S, Chaix D, Aymerich S, Labesse G, Declerck N, Proteins, 2008
2007
Common structural requirements for heptahelical domain function in class A and class C G protein-coupled receptors
Binet V, Duthey B, Lecaillon J, Vol C, Quoyer J, Labesse G, Pin JP, Prezeau L, J Biol Chem, 2007
ROP18 is a rhoptry kinase controlling the intracellular proliferation of Toxoplasma gondii
El Hajj H, Lebrun M, Arold ST, Vial H, Labesse G, Dubremetz JF, PLoS Pathog, 2007
Discovery of a highly active ligand of human pregnane x receptor: a case study from pharmacophore modeling and virtual screening to in vivo biological activity
Lemaire G, Benod C, Nahoum V, Pillon A, Boussioux AM, Guichou JF, Subra G, Pascussi JM, Bourguet W, Chavanieu A, Balaguer P, Mol Pharmacol, 2007
NAD kinases use substrate-assisted catalysis for specific recognition of NAD
Poncet-Montange G, Assairi L, Arold ST, Pochet S, Labesse G, J Biol Chem, 2007
Lack of dynamics in the MabA active site kills the enzyme activity: practical consequences for drug-design studies
Poncet-Montange G, Ducasse-Cabanot S, Quemard A, Labesse G, Cohen-Gonsaud M, Acta Crystallogr D Biol Crystallogr, 2007
2006
The structure of PknB in complex with mitoxantrone, an ATP-competitive inhibitor, suggests a mode of protein kinase regulation in mycobacteria
Wehenkel A, Fernandez P, Bellinzoni M, Catherinot V, Barilone N, Labesse G, Jackson M, Alzari PM, FEBS Lett, 2006
Structural basis for the Akt (PKB) kinase inhibition by the peptide Akt-in: an NMR study.
Ropars V, Guichou J-F, Auguin D, Barthe P, Noguchi M, Roumestand C, C. R. Chimie, 2006
Coupling of agonist binding to effector domain activation in metabotropic glutamate-like receptors
Rondard P, Liu J, Huang S, Malhaire F, Vol C, Pinault A, Labesse G, Pin JP, J Biol Chem, 2006
Structure-based design, synthesis, and biological evaluation of novel inhibitors of human cyclophilin A
Guichou JF, Viaud J, Mettling C, Subra G, Lin YL, Chavanieu A, J Med Chem, 2006
The endonuclease domain of bacteriophage terminases belongs to the resolvase/integrase/ribonuclease H superfamily: a bioinformatics analysis validated by a functional study on bacteriophage T5
Ponchon L, Boulanger P, Labesse G, Letellier L, J Biol Chem, 2006
Kinase Cak1 functionally interacts with the PAF1 complex and phosphatase Ssu72 via kinases Ctk1 and Bur1
Ganem C, Miled C, Facca C, Valay JG, Labesse G, Ben Hassine S, Mann C, Faye G, Mol Genet Genomics, 2006
The ROP2 family of Toxoplasma gondii rhoptry proteins: proteomic and genomic characterization and molecular modeling
El Hajj H, Demey E, Poncet J, Lebrun M, Wu B, Galeotti N, Fourmaux MN, Mercereau-Puijalon O, Vial H, Labesse G, Dubremetz JF, Proteomics, 2006
CRAACK: consensus program for NMR amino acid type assignment
Benod C, Delsuc MA, Pons JL, J Chem Inf Model, 2006
kinDOCK: a tool for comparative docking of protein kinase ligands
Martin L, Catherinot V, Labesse G, Nucleic Acids Res, 2006
2005
Crosslinking photosensitized by a ruthenium chelate as a tool for labeling and topographical studies of G-protein-coupled receptors
Duroux-Richard I, Vassault P, Subra G, Guichou JF, Richard E, Mouillac B, Barberis C, Marie J, Bonnafous JC, Chem Biol, 2005
Structural and functional analysis of the C-terminal STAS (sulfate transporter and anti-sigma antagonist) domain of the Arabidopsis thaliana sulfate transporter SULTR1.2
Rouached H, Berthomieu P, El Kassis E, Cathala N, Catherinot V, Labesse G, Davidian JC, Fourcroy P, J Biol Chem, 2005
Characterization of the interaction between retinoic acid receptor/retinoid X receptor (RAR/RXR) heterodimers and transcriptional coactivators through structural and fluorescence anisotropy studies
Pogenberg V, Guichou JF, Vivat-Hannah V, Kammerer S, Perez E, Germain P, de Lera AR, Gronemeyer H, Royer CA, Bourguet W, J Biol Chem, 2005
Structure of a liganded type 2 non-specific lipid-transfer protein from wheat and the molecular basis of lipid binding
Hoh F, Pons JL, Gautier MF, de Lamotte F, Dumas C, Acta Crystallogr D Biol Crystallogr, 2005
Internal point mutations of the capsid modify the serotype of Rice yellow mottle virus
Hebrard E, Pinel-Galzi A, Catherinot V, Labesse G, Brugidou C, Fargette D, J Virol, 2005
PAT: a protein analysis toolkit for integrated biocomputing on the web
Gracy J, Chiche L, Nucleic Acids Res, 2005
EvDTree: structure-dependent substitution profiles based on decision tree classification of 3D environments
Gelly JC, Chiche L, Gracy J, BMC Bioinformatics, 2005
Chemical cross-linking photosensitized by ruthenium chelate as a new tool for signaling studies
Duroux-Richard I, Guichou JF, Subra G, Mouillac B, Vassault P, Marie J, Chavanieu A, Bonnafous JC, Eur. Biophys. J., 2005
LEA3D: A Computer-Aided Ligand Design for Structure-Based Drug Design
Douguet D, Munier-Lehmann H, Labesse G, Pochet S, J Med Chem, 2005
Ligand-induced fit in mycobacterial MabA: the sequence-specific C-terminus locks the conformational change
Cohen-Gonsaud M, Ducasse-Cabanot S, Quemard A, Labesse G, Proteins, 2005
Strength and character of peptide/anion interactions
Chavanieu A, Guichou JF, Prado-Gotor R, Perez-Tejeda P, Jimenez R, Lopez-Cornejo P, Sanchez F, J Phys Chem B, 2005
The nuclear receptor coactivator PGC-1alpha exhibits modes of interaction with the estrogen receptor distinct from those of SRC-1
Bourdoncle A, Labesse G, Margueron R, Castet A, Cavailles V, Royer CA, J Mol Biol, 2005
Mutation at the exit gate of the salmonella gyrase a subunit suppresses a defect in the gyrase B subunit
Blanc-Potard AW, Labesse G, Figueroa-Bossi N, Bossi L, J Bacteriol, 2005
2004
Squash inhibitors: from structural motifs to macrocyclic knottins
Chiche L, Heitz A, Gelly JC, Gracy J, Chau PT, Ha PT, Hernandez JF, Le-Nguyen D, Curr Protein Pept Sci, 2004
Crystallization and preliminary crystallographic studies of MOMP (major outer membrane protein) from Campylobacter jejuni
Bolla JM, Saint N, Labesse G, Pages JM, Dumas C, Acta Crystallogr D Biol Crystallogr, 2004
Crystal Structure of the Coiled-coil Dimerization Motif of Geminin: Structural and Functional Insights on DNA Replication Regulation
Thepaut M, Maiorano D, Guichou JF, Auge MT, Dumas C, Mechali M, Padilla A, J Mol Biol, 2004
NMRb: a web-site repository for raw NMR datasets
Pons JL, Malliavin TE, Tramesel D, Delsuc MA, Bioinformatics, 2004
Purification and crystallization of the heterodimeric complex of RARbeta and RXRalpha ligand-binding domains in the active conformation
Pogenberg V, Guichou JF, Bourguet W, Acta Crystallogr D Biol Crystallogr, 2004
Design of an amphipatic a-helical hairpin peptide
Barthe P, Cohen-Gonsaud M, Aldrian-Herrada G, Chavanieu A, Labesse G, Roumestand C, Comptes Rendus Chimie, 2004
The KNOTTIN website and database: a new information system dedicated to the knottin scaffold
Gelly JC, Gracy J, Kaas Q, Le-Nguyen D, Heitz A, Chiche L, Nucleic Acids Res, 2004
In vitro inhibition of the Mycobacterium tuberculosis beta-ketoacyl-acyl carrier protein reductase MabA by isoniazid
Ducasse-Cabanot S, Cohen-Gonsaud M, Marrakchi H, Nguyen M, Zerbib D, Bernadou J, Daffe M, Labesse G, Quemard A, Antimicrob Agents Chemother, 2004
TLR-independent control of innate immunity in Caenorhabditis elegans by the TIR domain adaptor protein TIR-1, an ortholog of human SARM
Couillault C, Pujol N, Reboul J, Sabatier L, Guichou JF, Kohara Y, Ewbank JJ, Nat Immunol, 2004
Resuscitation-promoting factors possess a lysozyme-like domain
Cohen-Gonsaud M, Keep NH, Davies AP, Ward J, Henderson B, Labesse G, Trends in Biochemical Sciences, 2004
From molecular modelling to drug design
Cohen-Gonsaud M, Catherinot V, Labesse G, Douguet D, Nucleid Acids and Molecular Biology, Vol 15, Practical Bioinformatics, Ed. by J.M. Bujnicki (2004) Springer-Verlag, 2004
2003
The Assignment of Protein NMR Spectra: From Manual analysis to Automatic Processing
Catherinot V, Malliavin TE, Pons JL, Delsuc MA, G.I.T. Laboratory Journal, 2003
Use of the Protein MABA (FABG1) of MYCOBACTERIUM TUBERCULOSIS for designing and screening antibiotics
Quemard A, Labesse G, Daffe M, Ducasse S, Cohen-Gonsaud M, Douguet D, Marrakchi H, , 2003
Refined solution structure of a liganded type 2 wheat nonspecific lipid transfer protein
Pons JL, de Lamotte F, Gautier MF, Delsuc MA, J Biol Chem, 2003
Design of Mycobacterium tuberculosis thymidine monophosphate kinase inhibitors
Munier-Lehmann H, Pochet S, Dugue L, Dutruel O, Labesse G, Douget D, Nucleosides Nucleotides Nucleic Acids, 2003
Molecular recognition of paxillin LD motifs by the focal adhesion targeting domain
Hoellerer MK, Noble ME, Labesse G, Campbell ID, Werner JM, Arold ST, Structure (Camb), 2003
Ssu72 is a phosphatase essential for transcription termination of snoRNAs and specific mRNAs in yeast
Ganem C, Devaux F, Torchet C, Jacq C, Quevillon-Cheruel S, Labesse G, Facca C, Faye G, Embo J, 2003
Superposition of chemical shifts in NMR spectra can be overcome to determine automatically the structure of a protein
Auguin D, Catherinot V, Malliavin TE, Pons JL, Delsuc MA, Spectroscopy, 2003
2002
From sequence to structure to function: a case study
Douguet D, Bolla J-M, Munier-Lehmann H, Labesse G, Enzyme and Microbial Technology, 2002
Structural and nucleotide-binding properties of YajQ and YnaF, two Escherichia coli proteins of unknown function
Saveanu C, Miron S, Borza T, Craescu CT, Labesse G, Gagyi C, Popescu A, Schaeffer F, Namane A, Laurent-Winter C, Barzu O, Gilles AM, Protein Sci, 2002
Nucleoside analogues as inhibitors of thymidylate kinases: possible therapeutic applications
Pochet S, Dugue L, Douguet D, Labesse G, Munier-Lehmann H, Chembiochem, 2002
MabA (FabG1), a Mycobacterium tuberculosis protein involved in the long-chain fatty acid elongation system FAS-II
Marrakchi H, Ducasse S, Labesse G, Montrozier H, Margeat E, Emorine L, Charpentier X, Daffe M, Quemard A, Microbiology, 2002
Comparative modelling and immunochemical reactivity of Escherichia coli UMP kinase
Labesse G, Bucurenci N, Douguet D, Sakamoto H, Landais S, Gagyi C, Gilles AM, Barzu O, Biochem Biophys Res Commun, 2002
No ligand binding in the GB2 subunit of the GABA(B) receptor is required for activation and allosteric interaction between the subunits
Kniazeff J, Galvez T, Labesse G, Pin JP, J Neurosci, 2002
L'attribution des spectres RMN: de l'analyse manuelle au traitement automatique
Catherinot V, Malliavin TE, Pons JL, Delsuc MA, Bioforum, 2002
Crystal structure of MabA from Mycobacterium tuberculosis, a reductase involved in long-chain fatty acid biosynthesis
Cohen-Gonsaud M, Ducasse S, Hoh F, Zerbib D, Labesse G, Quemard A, J Mol Biol, 2002
Diacylglyceride kinases, sphingosine kinases and NAD kinases: distant relatives of 6-phosphofructokinases
Labesse G, Douguet D, Assairi L, Gilles AM, Trends Biochem Sci, 2002
2001
Biochemical characterization of the helper component of Cauliflower mosaic virus
Hebrard E, Drucker M, Leclerc D, Hohn T, Uzest M, Froissart R, Strub JM, Sanglier S, van Dorsselaer A, Padilla A, Labesse G, Blanc S, J Virol, 2001
Stepwise modelling optimization from sequence to quaternary structure
Labesse G, Douguet D, Gracy J, Pons J, Chiche L, 4th European Symposium of The Protein Society, 2001
MOMP, a divergent porin from Campylobacter: cloning and primary structural characterization
Labesse G, Garnotel E, Bonnel S, Dumas C, Pages JM, Bolla JM, Biochem Biophys Res Commun, 2001
Easier threading through web-based comparisons and cross-validations
Douguet D, Labesse G, Bioinformatics, 2001
Thymidylate kinase of Mycobacterium tuberculosis: a chimera sharing properties common to eukaryotic and bacterial enzymes
Munier-Lehmann H, Chaffotte A, Pochet S, Labesse G, Protein Sci, 2001
2000
MOMP (major outer membrane protein) of Campylobacter jejuni; a versatile pore-forming protein
De E, Jullien M, Labesse G, Pages JM, Molle G, Bolla JM, FEBS Lett, 2000
The Cystine-Stabilized Beta-sheet motif is a common and useful motif por protein engineering
Heitz A, Le Nguyen D, Hernandez JF, Gracy J, Chiche L, Peptide 2000, 2000
Molecular cloning and partial characterization of a plant VAP33 homologue with a major sperm protein domain
Laurent F, Labesse G, de Wit P, Biochem Biophys Res Commun, 2000
1999
Characterization and molecular cloning of an adenosine kinase from Babesia canis rossi
Carret C, Delbecq S, Labesse G, Carcy B, Precigout E, Moubri K, Schetters TP, Gorenflot A, Eur J Biochem, 1999
Sequence analysis identifies a ras-associating (RA)-like domain in the N-termini of band 4.1/JEF domains and in the Grb7/10/14 adapter family
Wojcik J, Girault JA, Labesse G, Chomilier J, Mornon JP, Callebaut I, Biochem Biophys Res Commun, 1999
Direct selection of EGF mutants displayed on filamentous phage using cells overexpressing EGF receptor
Souriau C, Gracy J, Chiche L, Weill M, Biol Chem, 1999
Rescue : an Artificial Neural Network tool for helping the NMR spectral assignment of proteins
Pons JL, Delsuc M-A, J. Bio. NMR, 1999
The N-termini of FAK and JAKs contain divergent band 4.1 domains
Girault JA, Labesse G, Mornon JP, Callebaut I, Trends Biochem Sci, 1999
Structure modelling and site-directed mutagenesis of the rat aromatic L-amino acid pyridoxal 5'-phosphate-dependent decarboxylase: a functional study
Poupon A, Jebai F, Labesse G, Gros F, Thibault J, Mornon JP, Krieger M, Proteins, 1999
1998
1996
| Director | Emmanuel Margeat |
| Deputy directors | Vanessa Delfosse Martin Cohen-Gonsaud |
| Admin.Resp. | Florence Lepage |
| (33) 04 67 41 79 01 |
| Manager.Assist. | Marion Boutin |
| (33) 04 67 41 79 04 |
