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Avoiding Drug Resistance by Substrate Envelope-Guided Design: Toward Potent and Robust HCV NS3/4A Protease Inhibitors.

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第一作者： Ashley N,Matthew

第一单位： Department of Biochemistry and Molecular Pharmacology, University of Massachusetts Medical School, Worcester, Massachusetts, USA.

作者： Ashley N,Matthew ^[1] ; Jacqueto,Zephyr ^[1] ; Desaboini,Nageswara Rao ^[1] ; Mina,Henes ^[1] ; Wasih,Kamran ^[1] ; Klajdi,Kosovrasti ^[1] ; Adam K,Hedger ^[1] ; Gordon J,Lockbaum ^[1] ; Jennifer,Timm ^[1] ; Akbar,Ali ^[1] ; Nese,Kurt Yilmaz ^[2] ; Celia A,Schiffer ^[2]

作者单位： Department of Biochemistry and Molecular Pharmacology, University of Massachusetts Medical School, Worcester, Massachusetts, USA. ^[1] Department of Biochemistry and Molecular Pharmacology, University of Massachusetts Medical School, Worcester, Massachusetts, USA Nese.KurtYilmaz@umassmed.edu Celia.Schiffer@umassmed.edu. ^[2]

关键词 X-ray crystallography drug design drug resistance mechanisms hepatitis C virus structural biology

医学主题词抗病毒药(Antiviral Agents);催化域(Catalytic Domain);药物设计(Drug Design);抗药性, 病毒(Drug Resistance, Viral);人类(Humans);分子动力学模拟(Molecular Dynamics Simulation);分子结构(Molecular Structure);突变(Mutation);蛋白酶抑制药(Protease Inhibitors);构效关系(Structure-Activity Relationship);病毒非结构蛋白质类(Viral Nonstructural Proteins)

DOI 10.1128/mBio.00172-20

PMID 32234812

发布时间 2024-09-22

基金项目

F31 GM103259/GM/NIGMS NIH HHS/United States F31 GM119345/GM/NIGMS NIH HHS/United States F31 GM131635/GM/NIGMS NIH HHS/United States R01 AI085051/AI/NIAID NIH HHS/United States

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