首页> Scientific reports> A conformational rearrangement of the SARS-CoV-2 host protein sigma-1 is required for antiviral activity: insights from a combined in-silico/in-vitro approach.

A conformational rearrangement of the SARS-CoV-2 host protein sigma-1 is required for antiviral activity: insights from a combined in-silico/in-vitro approach.

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第一作者： Francesca Serena,Abatematteo

第一单位： Dipartimento di Farmacia-Scienze del Farmaco, Università degli Studi di Bari Aldo Moro, Via Orabona, 4, 70125, Bari, Italy.

作者： Francesca Serena,Abatematteo ^[1] ; Pietro,Delre ^[2] ; Ivan,Mercurio ^[3] ; Veronica V,Rezelj ^[4] ; Dritan,Siliqi ^[2] ; Stephanie,Beaucourt ^[4] ; Gianluca,Lattanzi ^[5] ; Nicola Antonio,Colabufo ^[1] ; Marcello,Leopoldo ^[1] ; Michele,Saviano ^[6] ; Marco,Vignuzzi ^[7] ; Giuseppe Felice,Mangiatordi ^[8] ; Carmen,Abate ^[9]

作者单位： Dipartimento di Farmacia-Scienze del Farmaco, Università degli Studi di Bari Aldo Moro, Via Orabona, 4, 70125, Bari, Italy. ^[1] Consiglio Nazionale delle Ricerche (CNR), Istituto di Cristallografia, Via Amendola 122/O, 70126, Bari, Italy. ^[2] Consiglio Nazionale delle Ricerche (CNR), Istituto di Cristallografia, Via Amendola 122/O, 70126, Bari, Italy.;Department of Environmental, Biological and Pharmaceutical Sciences and Technologies, University of Campania "Luigi Vanvitelli", Via Antonio Vivaldi 43, 81100, Caserta, Italy. ^[3] Viral Populations and Pathogenesis Unit, UMR 3569, CNRS, Institut Pasteur, Paris, France. ^[4] Department of Physics, University of Trento, Via Sommarive 9, 38123, Povo-Trento, Italy.;TIFPA Trento Institute for Fundamental Physics and Applications, Via Sommarive 9, 38123, Povo-Trento, Italy. ^[5] Consiglio Nazionale delle Ricerche (CNR), Istituto di Cristallografia, Via Vivaldi 43, 81100, Caserta, Italy. ^[6] Viral Populations and Pathogenesis Unit, UMR 3569, CNRS, Institut Pasteur, Paris, France.;A*STAR Infectious Diseases Labs (A*STAR ID Labs), Agency for Science, Technology and Research (A*STAR), 8A Biomedical Grove, Immunos #05-13, Singapore, 138648, Singapore. ^[7] Consiglio Nazionale delle Ricerche (CNR), Istituto di Cristallografia, Via Amendola 122/O, 70126, Bari, Italy. giuseppe.mangiatordi@ic.cnr.it. ^[8] Dipartimento di Farmacia-Scienze del Farmaco, Università degli Studi di Bari Aldo Moro, Via Orabona, 4, 70125, Bari, Italy. carmen.abate@uniba.it.;Consiglio Nazionale delle Ricerche (CNR), Istituto di Cristallografia, Via Amendola 122/O, 70126, Bari, Italy. carmen.abate@uniba.it. ^[9]

医学主题词人类(Humans);抗病毒药(Antiviral Agents);配体(Ligands);分子动力学模拟(Molecular Dynamics Simulation)

DOI 10.1038/s41598-023-39662-w

PMID 37550340

发布时间 2023-11-21

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准确一般字义偏差语意偏离译文作用小提交