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PanDDA files from a ligand screen against the NSP3 macrodomain of SARS-CoV-2 - ligands from linking with FRESCO

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NIAID Data Ecosystem2026-03-14 收录
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https://zenodo.org/record/7231821
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资源简介:
This deposition contains the X-ray diffraction data used to run PanDDA in the ligand screen against the NSP3 macrodomain of SARS-CoV-2 described in McCorkindale et al. 2022 (https://doi.org/10.1101/2022.11.21.517375). mac1_pandda.zip contains the structure factor intensities, PanDDA input/ouput and refined models/maps. A description of the files can be found in the README file.  mac1_ligand-bound_states.zip contains the ligand-bound states extracted from the multi-state PDB files.
创建时间:
2022-11-30
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