Data quality metrics extracted from 8u4f.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": "386140a9303652abdeac7f86a7e3a2b8",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 133.505,
    "b": 67.641,
    "c": 100.640,
    "alpha": 90.00,
    "beta": 124.83,
    "gamma": 90.00
  },
  "wavelengths": [1.45866],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50,2.01],
    "number_observations_unique": 48607,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.1777
      },
      {
        "type": "R(meas)",
        "value": 0.2017
      },
      {
        "type": "R(pim)",
        "value": 0.09327
      },
      {
        "type": "I/SigI",
        "value": 7.73
      },
      {
        "type": "Completeness",
        "value": 98.77
      },
      {
        "type": "Redundancy",
        "value": 4.2
      },
      {
        "type": "CC(1/2)",
        "value": 0.988
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [5.99,2.01],
      "number_observations_unique": 48606,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 98.4
        },
        {
          "type": "CC(1/2)",
          "value": 0.98
        }
      ]
    }
  ]

}
  

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


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