Data quality metrics extracted from 1kyz.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": "e0f663422081a88510d34ae3c69c67f0",
  "space_group_name": "P 1 2 1",
  "unit_cell": {
    "a": 103.729,
    "b": 61.865,
    "c": 111.229,
    "alpha": 90.00,
    "beta": 112.18,
    "gamma": 90.00
  },
  "wavelengths": [1.08000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [99,2.1],
    "number_observations_unique": 66087,
    "quality_factors": [
      {
        "type": "Completeness",
        "value": 96.8
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.23,2.19],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 91
        }
      ]
    }
  ]

}
  

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


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