Data quality metrics extracted from 8cij.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": "82a693c25e64b708145846c555281d13",
  "space_group_name": "P 41 21 2",
  "unit_cell": {
    "a": 75.976,
    "b": 75.976,
    "c": 131.973,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97957],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [65.844,2.821],
    "number_observations_unique": 8077,
    "quality_factors": [
      {
        "type": "R(pim)",
        "value": 0.053
      },
      {
        "type": "I/SigI",
        "value": 11.3
      },
      {
        "type": "Completeness",
        "value": 82.1
      },
      {
        "type": "Redundancy",
        "value": 15.6
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.027,2.821],
      "number_observations_unique": 404,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 0.717
        },
        {
          "type": "CC(1/2)",
          "value": 0.500
        }
      ]
    }
  ]

}
  

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


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