Dataset Open Access

Raw diffraction data for structure of SARS-CoV-2 main protease with PCM-0102432 (ID: mpro-x1392 / PDB: 5RFT)

Aragao, David; Brandao-Neto, Jose; Carbery, Anna; Crawshaw, Adam; Dias, Alexandre; Douangamath, Alice; Dunnett, Louise; Fearon, Daren; Flaig, Ralf; Gehrtz, Paul; Hall, Dave; Krojer, Tobias; London, Nir; Lukacik, Petra; Mazzorana, Marco; McAuley, Katherine; Owen, David; Powell, Ailsa; Reddi, Rambabu; Resnick, Efrat; Skyner, Rachael; Snee, Matt; Strain-Damerell, Claire; Stuart, Dave; von Delft, Frank; Walsh, Martin; Wild, Conor; Williams, Mark; Winter, Graeme

Raw diffraction data for mpro-x1392 / PDB ID 5RFT (see: https://www.ebi.ac.uk/pdbe/entry/pdb/5RFT) - SARS-CoV-2 main protease in complex with PCM-0102432 (SMILES:ClCC(=O)N1CC(c2ccccc2)c3ccccc3C1) collected as part of an XChem crystallographic fragment screening campaign on beamline i04-1 at Diamond Light Source. The deposited structure was automatically processed with standard Diamond tools and PanDDA, however the raw data are being made available to allow reanalysis by any interested party. For more details see: https://www.diamond.ac.uk/covid-19/for-scientists/Main-protease-structure-and-XChem.html

Files (661.7 MB)
Name Size
mpro-x1392.zip
md5:5a60d7382075a3f9988728458901410d
661.7 MB Download
252
4
views
downloads
All versions This version
Views 252252
Downloads 44
Data volume 2.6 GB2.6 GB
Unique views 218218
Unique downloads 44

Share

Cite as