Dataset Open Access

Raw diffraction data for structure of SARS-CoV-2 main protease with NCL-00023830 (ID: mpro-x0946 / PDB: 5RF1)

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-x0946 / PDB ID 5RF1 (see: - SARS-CoV-2 main protease in complex with NCL-00023830 (SMILES:BrC1=CC=C(S(N)(=O)=O)C=C1) 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:

Files (484.5 MB)
Name Size
484.5 MB Download
All versions This version
Views 323323
Downloads 55
Data volume 2.4 GB2.4 GB
Unique views 301301
Unique downloads 55


Cite as