Dataset Open Access

Raw diffraction data for structure of SARS-CoV-2 main protease with Z1400780201 (ID: mpro-x1093 / PDB: 5RF7)

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


JSON Export

{
  "files": [
    {
      "links": {
        "self": "https://zenodo.org/api/files/888848ee-f487-4201-a45b-789ba675eed3/mpro-x1093.zip"
      }, 
      "checksum": "md5:7a05b034cc17b97d1dee7652b6e3f371", 
      "bucket": "888848ee-f487-4201-a45b-789ba675eed3", 
      "key": "mpro-x1093.zip", 
      "type": "zip", 
      "size": 752758754
    }
  ], 
  "owners": [
    4373
  ], 
  "doi": "10.5281/zenodo.3731246", 
  "stats": {
    "version_unique_downloads": 21.0, 
    "unique_views": 414.0, 
    "views": 466.0, 
    "version_views": 466.0, 
    "unique_downloads": 21.0, 
    "version_unique_views": 414.0, 
    "volume": 16560692588.0, 
    "version_downloads": 22.0, 
    "downloads": 22.0, 
    "version_volume": 16560692588.0
  }, 
  "links": {
    "doi": "https://doi.org/10.5281/zenodo.3731246", 
    "conceptdoi": "https://doi.org/10.5281/zenodo.3731245", 
    "bucket": "https://zenodo.org/api/files/888848ee-f487-4201-a45b-789ba675eed3", 
    "conceptbadge": "https://zenodo.org/badge/doi/10.5281/zenodo.3731245.svg", 
    "html": "https://zenodo.org/record/3731246", 
    "latest_html": "https://zenodo.org/record/3731246", 
    "badge": "https://zenodo.org/badge/doi/10.5281/zenodo.3731246.svg", 
    "latest": "https://zenodo.org/api/records/3731246"
  }, 
  "conceptdoi": "10.5281/zenodo.3731245", 
  "created": "2020-03-27T14:15:44.167186+00:00", 
  "updated": "2020-03-30T07:56:20.337232+00:00", 
  "conceptrecid": "3731245", 
  "revision": 5, 
  "id": 3731246, 
  "metadata": {
    "access_right_category": "success", 
    "doi": "10.5281/zenodo.3731246", 
    "description": "Raw diffraction data for mpro-x1093 / PDB ID 5RF7 (see: https://www.ebi.ac.uk/pdbe/entry/pdb/5RF7) - SARS-CoV-2 main protease in complex with Z1400780201  (SMILES:CN1CCN(CC1)C(=O)CC1=CNC2=NC=CC=C12) 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. \n\nFor more details see: https://www.diamond.ac.uk/covid-19/for-scientists/Main-protease-structure-and-XChem.html", 
    "license": {
      "id": "CC0-1.0"
    }, 
    "title": "Raw diffraction data for structure of SARS-CoV-2 main protease with Z1400780201  (ID: mpro-x1093 / PDB: 5RF7)", 
    "relations": {
      "version": [
        {
          "count": 1, 
          "index": 0, 
          "parent": {
            "pid_type": "recid", 
            "pid_value": "3731245"
          }, 
          "is_last": true, 
          "last_child": {
            "pid_type": "recid", 
            "pid_value": "3731246"
          }
        }
      ]
    }, 
    "communities": [
      {
        "id": "covid-19"
      }, 
      {
        "id": "mx"
      }
    ], 
    "keywords": [
      "COVID-19", 
      "SARS-CoV-2 main protease", 
      "automated upload", 
      "PDB:5RF7", 
      "Diamond Light Source / MX / XChem"
    ], 
    "publication_date": "2020-03-30", 
    "creators": [
      {
        "affiliation": "Diamond Light Source", 
        "name": "Aragao, David"
      }, 
      {
        "affiliation": "Diamond Light Source", 
        "name": "Brandao-Neto, Jose"
      }, 
      {
        "affiliation": "SGC-Oxford", 
        "name": "Carbery, Anna"
      }, 
      {
        "affiliation": "Diamond Light Source", 
        "name": "Crawshaw, Adam"
      }, 
      {
        "affiliation": "Diamond Light Source", 
        "name": "Dias, Alexandre"
      }, 
      {
        "affiliation": "Diamond Light Source", 
        "name": "Douangamath, Alice"
      }, 
      {
        "affiliation": "Diamond Light Source", 
        "name": "Dunnett, Louise"
      }, 
      {
        "affiliation": "Diamond Light Source", 
        "name": "Fearon, Daren"
      }, 
      {
        "affiliation": "Diamond Light Source", 
        "name": "Flaig, Ralf"
      }, 
      {
        "affiliation": "Weizmann Institute, Israel", 
        "name": "Gehrtz, Paul"
      }, 
      {
        "affiliation": "Diamond Light Source", 
        "name": "Hall, Dave"
      }, 
      {
        "affiliation": "SGC-Oxford", 
        "name": "Krojer, Tobias"
      }, 
      {
        "affiliation": "Weizmann Institute, Israel", 
        "name": "London, Nir"
      }, 
      {
        "affiliation": "Diamond Light Source", 
        "name": "Lukacik, Petra"
      }, 
      {
        "affiliation": "Diamond Light Source", 
        "name": "Mazzorana, Marco"
      }, 
      {
        "affiliation": "Diamond Light Source", 
        "name": "McAuley, Katherine"
      }, 
      {
        "affiliation": "Diamond Light Source", 
        "name": "Owen, David"
      }, 
      {
        "affiliation": "Diamond Light Source", 
        "name": "Powell, Ailsa"
      }, 
      {
        "affiliation": "Weizmann Institute, Israel", 
        "name": "Reddi, Rambabu"
      }, 
      {
        "affiliation": "Weizmann Institute, Israel", 
        "name": "Resnick, Efrat"
      }, 
      {
        "affiliation": "SGC-Oxford", 
        "name": "Skyner, Rachael"
      }, 
      {
        "affiliation": "Diamond Light Source / University of Manchester", 
        "name": "Snee, Matt"
      }, 
      {
        "affiliation": "Diamond Light Source", 
        "name": "Strain-Damerell, Claire"
      }, 
      {
        "affiliation": "Diamond Light Source", 
        "name": "Stuart, Dave"
      }, 
      {
        "affiliation": "SGC-Oxford / Diamond Light Source", 
        "name": "von Delft, Frank"
      }, 
      {
        "affiliation": "Diamond Light Source", 
        "name": "Walsh, Martin"
      }, 
      {
        "affiliation": "SGC-Oxford", 
        "name": "Wild, Conor"
      }, 
      {
        "affiliation": "Diamond Light Source", 
        "name": "Williams, Mark"
      }, 
      {
        "affiliation": "Diamond Light Source", 
        "name": "Winter, Graeme"
      }
    ], 
    "access_right": "open", 
    "resource_type": {
      "type": "dataset", 
      "title": "Dataset"
    }, 
    "related_identifiers": [
      {
        "scheme": "doi", 
        "identifier": "10.5281/zenodo.3731245", 
        "relation": "isVersionOf"
      }
    ]
  }
}
466
22
views
downloads
All versions This version
Views 466466
Downloads 2222
Data volume 16.6 GB16.6 GB
Unique views 414414
Unique downloads 2121

Share

Cite as