Data quality metrics extracted from 8rsk.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
  "mxlims_type": "ReflectionSet",
  "version": "0.2.2",
  "uuid": "ceb93c4055469d11409edb45f787c4a6",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 104.146,
    "b": 110.443,
    "c": 104.610,
    "alpha": 90.000,
    "beta": 119.559,
    "gamma": 90.000
  },
  "wavelengths": [0.92819],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [69.955,2.359],
    "number_observations_unique": 42263,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 7.3
      },
      {
        "type": "Completeness",
        "value": 99.9
      },
      {
        "type": "Redundancy",
        "value": 3.1
      },
      {
        "type": "CC(1/2)",
        "value": 0.993
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.42,2.36],
      "number_observations_unique": 3109,
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 0.9
        },
        {
          "type": "CC(1/2)",
          "value": 0.494
        }
      ]
    }
  ]

}
  

Table 1 generated from MXLIMS-JSON (via JavaScript):


Binned data generated from MXLIMS-JSON (via JavaScript):