Data quality metrics extracted from 1kxz.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": "a8062aa17d9bef7ff8ec97ee633124ee",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 59.1,
    "b": 76.0,
    "c": 97.2,
    "alpha": 70.9,
    "beta": 78.8,
    "gamma": 66.7
  },
  "wavelengths": [0.97956],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50,2.70],
    "number_observations_unique": 39161,
    "quality_factors": [
      {
        "type": "Completeness",
        "value": 98.8
      },
      {
        "type": "Redundancy",
        "value": 1.91
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.77,2.70],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 97.6
        }
      ]
    }
  ]

}
  

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


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