Fraser Bryan J, Beldar Serap, Seitova Almagul, Hutchinson Ashley, Mannar Dhiraj, Li Yanjun, Kwon Daniel, Tan Ruiyan, Wilson Ryan P, Leopold Karoline, Subramaniam Sriram, Halabelian Levon, Arrowsmith Cheryl H, Bénard François
Department of Molecular Oncology, British Columbia Cancer Research Institute, Vancouver, British Columbia, Canada.
Department of Radiology, University of British Columbia, Vancouver, British Columbia, Canada.
Nat Chem Biol. 2022 Sep;18(9):963-971. doi: 10.1038/s41589-022-01059-7. Epub 2022 Jun 8.
Transmembrane protease, serine 2 (TMPRSS2) has been identified as key host cell factor for viral entry and pathogenesis of SARS-CoV-2. Specifically, TMPRSS2 proteolytically processes the SARS-CoV-2 Spike (S) protein, enabling virus-host membrane fusion and infection of the airways. We present here a recombinant production strategy for enzymatically active TMPRSS2 and characterization of its matured proteolytic activity, as well as its 1.95 Å X-ray cocrystal structure with the synthetic protease inhibitor nafamostat. Our study provides a structural basis for the potent but nonspecific inhibition by nafamostat and identifies distinguishing features of the TMPRSS2 substrate binding pocket that explain specificity. TMPRSS2 cleaved SARS-CoV-2 S protein at multiple sites, including the canonical S1/S2 cleavage site. We ranked the potency of clinical protease inhibitors with half-maximal inhibitory concentrations ranging from 1.4 nM to 120 µM and determined inhibitor mechanisms of action, providing the groundwork for drug development efforts to selectively inhibit TMPRSS2.
跨膜蛋白酶丝氨酸2(TMPRSS2)已被确定为严重急性呼吸综合征冠状病毒2(SARS-CoV-2)病毒进入和发病机制的关键宿主细胞因子。具体而言,TMPRSS2通过蛋白水解作用处理SARS-CoV-2刺突(S)蛋白,实现病毒与宿主细胞膜融合并感染气道。我们在此展示了一种用于重组生产具有酶活性的TMPRSS2的策略,并对其成熟的蛋白水解活性进行了表征,还展示了其与合成蛋白酶抑制剂那法莫司他的1.95埃X射线共晶体结构。我们的研究为那法莫司他的强效但非特异性抑制提供了结构基础,并确定了TMPRSS2底物结合口袋的独特特征,这些特征解释了其特异性。TMPRSS2在多个位点切割SARS-CoV-2 S蛋白,包括典型的S1/S2切割位点。我们对临床蛋白酶抑制剂的效力进行了排名,其半数最大抑制浓度范围为1.4纳摩尔至120微摩尔,并确定了抑制剂的作用机制,为选择性抑制TMPRSS2的药物开发工作奠定了基础。