Data quality metrics extracted from 5tuk.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": "7a8f1946c0996e86d598c17ba3d4a31d",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 83.49,
    "b": 81.69,
    "c": 127.13,
    "alpha": 90.00,
    "beta": 96.79,
    "gamma": 90.00
  },
  "wavelengths": [1.00003],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [20,1.85],
    "number_observations_unique": 144467,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 11.93
      },
      {
        "type": "Completeness",
        "value": 99.7
      },
      {
        "type": "Redundancy",
        "value": 3.77
      },
      {
        "type": "CC(1/2)",
        "value": 0.998
      }
    ]
  }
}
  

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


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