Data quality metrics extracted from 8xwx.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": "1de4b03a7044882b4461c6ef46bd1e98",
  "space_group_name": "C 2 2 2",
  "unit_cell": {
    "a": 104.632,
    "b": 237.267,
    "c": 90.622,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [40.96,2.69],
    "number_observations_unique": 27276,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.050
      },
      {
        "type": "R(pim)",
        "value": 0.018
      },
      {
        "type": "I/SigI",
        "value": 99.8
      },
      {
        "type": "Completeness",
        "value": 85.80
      },
      {
        "type": "Redundancy",
        "value": 8.2
      },
      {
        "type": "CC(1/2)",
        "value": 0.993
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.76,2.69],
      "number_observations_unique": 946,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.587
        },
        {
          "type": "Completeness",
          "value": 42.16
        },
        {
          "type": "CC(1/2)",
          "value": 0.57
        }
      ]
    }
  ]

}
  

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


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