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

<p>This deposition contains the X-ray diffraction data&nbsp;used to run PanDDA&nbsp;in the&nbsp;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).</p> <p>mac1_pandda.zip contains the structure factor intensities,&nbsp;PanDDA input/ouput and&nbsp;refined models/maps.&nbsp;A description of the files can be found in the README&nbsp;file.&nbsp;</p> <p>mac1_ligand-bound_states.zip contains the ligand-bound states extracted from the multi-state PDB files.&nbsp;</p>

ShareScore

32/100

Overall dataset sharing score

Score breakdown

These five areas show where the dataset supports — or may limit — practical reuse.

Stewardship
4
Harmonization
4
Access
16
Reuse readiness
8
Engagement
0