Remdesivir overcomes the S861 roadblock in SARS-CoV-2 polymerase elongation complex

Cell Rep. 2021 Oct 26;37(4):109882. doi: 10.1016/j.celrep.2021.109882. Epub 2021 Oct 8.

Abstract

Remdesivir (RDV), a nucleotide analog with broad-spectrum features, has exhibited effectiveness in COVID-19 treatment. However, the precise working mechanism of RDV when targeting the viral RNA-dependent RNA polymerase (RdRP) has not been fully elucidated. Here, we solve a 3.0-Å structure of severe acute respiratory syndrome coronavirus 2 (SARS-CoV-2) RdRP elongation complex (EC) and assess RDV intervention in polymerase elongation phase. Although RDV could induce an "i+3" delayed termination in meta-stable complexes, only pausing and subsequent elongation are observed in the EC. A comparative investigation using an enterovirus RdRP further confirms similar delayed intervention and demonstrates that steric hindrance of the RDV-characteristic 1'-cyano at the -4 position is responsible for the "i+3" intervention, although two representative Flaviviridae RdRPs do not exhibit similar behavior. A comparison of representative viral RdRP catalytic complex structures indicates that the product RNA backbone encounters highly conserved structural elements, highlighting the broad-spectrum intervention potential of 1'-modified nucleotide analogs in anti-RNA virus drug development.

Keywords: RNA-dependent RNA polymerase; SARS-CoV-2; broad-spectrum; elongation complex; remdesivir.

Publication types

  • Research Support, Non-U.S. Gov't

MeSH terms

  • Adenosine Monophosphate / analogs & derivatives*
  • Adenosine Monophosphate / pharmacology
  • Alanine / analogs & derivatives*
  • Alanine / pharmacology
  • Antiviral Agents / pharmacology*
  • COVID-19 Drug Treatment
  • Cryoelectron Microscopy
  • Humans
  • RNA, Viral / chemistry
  • RNA, Viral / drug effects
  • RNA-Dependent RNA Polymerase / chemistry
  • RNA-Dependent RNA Polymerase / drug effects*
  • SARS-CoV-2 / chemistry
  • SARS-CoV-2 / drug effects*
  • Viral Proteins / chemistry
  • Viral Proteins / drug effects*
  • Virus Replication / drug effects

Substances

  • Antiviral Agents
  • RNA, Viral
  • Viral Proteins
  • remdesivir
  • Adenosine Monophosphate
  • RNA-Dependent RNA Polymerase
  • Alanine