期刊
CHEMBIOCHEM
卷 23, 期 6, 页码 -出版社
WILEY-V C H VERLAG GMBH
DOI: 10.1002/cbic.202100681
关键词
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资金
- EXIST project
- Berlin University Alliance G2 Global Health: Corona Virus Pre Exploration Project
- IRTG 2662 'CHARGING INTO THE FUTURE': Understanding the interaction of polyelectrolytes with biosystems
- Max-Planck MaxWater initiative
- Projekt DEAL
The novel SARS-CoV-2 mutant Omicron, with its over 60 mutations, is likely to spread and dominate worldwide. The higher infection potential of Omicron may be attributed to the increased occurrence of positively charged amino acids in its spike protein, resulting in enhanced binding to cellular receptors.
Evidence is strengthening to suggest that the novel SARS-CoV-2 mutant Omicron, with its more than 60 mutations, will spread and dominate worldwide. Although the mutations in the spike protein are known, the molecular basis for why the additional mutations in the spike protein that have not previously occurred account for Omicron's higher infection potential, is not understood. We propose, based on chemical rational and molecular dynamics simulations, that the elevated occurrence of positively charged amino acids in certain domains of the spike protein (Delta: +4; Omicron: +5 vs. wild type) increases binding to cellular polyanionic receptors, such as heparan sulfate due to multivalent charge-charge interactions. This observation is a starting point for targeted drug development.
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