Data quality metrics extracted from 8wzr.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": "6ba6e576b5961d5e334c4a85569c409c",
  "space_group_name": "P 43 21 2",
  "unit_cell": {
    "a": 81.7,
    "b": 81.7,
    "c": 37.9,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [31.69,1.6],
    "number_observations_unique": 17528,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 9.55
      },
      {
        "type": "Completeness",
        "value": 100
      },
      {
        "type": "Redundancy",
        "value": 820.09
      },
      {
        "type": "CC(1/2)",
        "value": 0.9896
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.62,1.60],
      "number_observations_unique": 859,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.4864
        }
      ]
    }
  ]

}
  

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


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