Data quality metrics extracted from 6k4r.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": "7ce5aeffbfed035ff5098dd1189a3d2f",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 60.846,
    "b": 159.178,
    "c": 135.032,
    "alpha": 90.00,
    "beta": 101.78,
    "gamma": 90.00
  },
  "wavelengths": [0.97918],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [132.187,3.109],
    "number_observations_unique": 41924,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 2
      },
      {
        "type": "Completeness",
        "value": 99.8
      },
      {
        "type": "Redundancy",
        "value": 6.5
      },
      {
        "type": "CC(1/2)",
        "value": 0.997
      }
    ]
  }
}
  

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


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