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Structures of picomolar bivalent inhibitors of protein kinase CK2 active against β-coronavirus replication

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DataCite Commons2025-09-10 更新2026-05-03 收录
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https://doi.esrf.fr/10.15151/ESRF-DC-2123184537
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The protein casein kinase 2 (CK2) has been shown to be upregulated in SARS-CoV-2 infections. However, few inhibitors have been tested for antiviral activity against coronaviruses. In this study, highly potent and selective bivalent inhibitors targeting the protein kinase CK2 were developed. The chemical structure of the well-known inhibitor CX-4945 was used as an anchor for the ATP-binding site and was linked by polar and aliphatic linkers to chemical structures that bind the cryptic αD pocket of CK2. Here are the datasets of the structures of bivalent inhibitors described in the publication. Related PDBs : 9QRH, 9QRI, 9QRJ, 9QSR, 9QSS, 9QSU, 9QSV
提供机构:
European Synchrotron Radiation Facility
创建时间:
2025-09-10
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