March 30, 2020 Dataset Open Access

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

Dublin Core Export

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  <dc:creator>Aragao, David</dc:creator>
  <dc:creator>Brandao-Neto, Jose</dc:creator>
  <dc:creator>Carbery, Anna</dc:creator>
  <dc:creator>Crawshaw, Adam</dc:creator>
  <dc:creator>Dias, Alexandre</dc:creator>
  <dc:creator>Douangamath, Alice</dc:creator>
  <dc:creator>Dunnett, Louise</dc:creator>
  <dc:creator>Fearon, Daren</dc:creator>
  <dc:creator>Flaig, Ralf</dc:creator>
  <dc:creator>Gehrtz, Paul</dc:creator>
  <dc:creator>Hall, Dave</dc:creator>
  <dc:creator>Krojer, Tobias</dc:creator>
  <dc:creator>London, Nir</dc:creator>
  <dc:creator>Lukacik, Petra</dc:creator>
  <dc:creator>Mazzorana, Marco</dc:creator>
  <dc:creator>McAuley, Katherine</dc:creator>
  <dc:creator>Owen, David</dc:creator>
  <dc:creator>Powell, Ailsa</dc:creator>
  <dc:creator>Reddi, Rambabu</dc:creator>
  <dc:creator>Resnick, Efrat</dc:creator>
  <dc:creator>Skyner, Rachael</dc:creator>
  <dc:creator>Snee, Matt</dc:creator>
  <dc:creator>Strain-Damerell, Claire</dc:creator>
  <dc:creator>Stuart, Dave</dc:creator>
  <dc:creator>von Delft, Frank</dc:creator>
  <dc:creator>Walsh, Martin</dc:creator>
  <dc:creator>Wild, Conor</dc:creator>
  <dc:creator>Williams, Mark</dc:creator>
  <dc:creator>Winter, Graeme</dc:creator>
  <dc:date>2020-03-30</dc:date>
  <dc:description>Raw diffraction data for mpro-x0820 / PDB ID 5REW (see: https://www.ebi.ac.uk/pdbe/entry/pdb/5REW) - SARS-CoV-2 main protease in complex with PCM-0102275 (SMILES:CC(NC(=O)CCl)c1cccc2ccccc12) 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</dc:description>
  <dc:identifier>https://zenodo.org/record/3731006</dc:identifier>
  <dc:identifier>10.5281/zenodo.3731006</dc:identifier>
  <dc:identifier>oai:zenodo.org:3731006</dc:identifier>
  <dc:relation>doi:10.5281/zenodo.3731005</dc:relation>
  <dc:relation>url:https://zenodo.org/communities/covid-19</dc:relation>
  <dc:relation>url:https://zenodo.org/communities/mx</dc:relation>
  <dc:rights>info:eu-repo/semantics/openAccess</dc:rights>
  <dc:rights>https://creativecommons.org/publicdomain/zero/1.0/legalcode</dc:rights>
  <dc:subject>COVID-19</dc:subject>
  <dc:subject>SARS-CoV-2 main protease</dc:subject>
  <dc:subject>automated upload</dc:subject>
  <dc:subject>PDB:5REW</dc:subject>
  <dc:subject>Diamond Light Source / MX / XChem</dc:subject>
  <dc:title>Raw diffraction data for structure of SARS-CoV-2 main protease with PCM-0102275 (ID: mpro-x0820 / PDB: 5REW)</dc:title>
  <dc:type>info:eu-repo/semantics/other</dc:type>
  <dc:type>dataset</dc:type>
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