Data quality metrics extracted from 7k4p.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": "9e48694e987947e64e0b510a20b9321d",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 50.61,
    "b": 58.03,
    "c": 81.61,
    "alpha": 90.00,
    "beta": 101.42,
    "gamma": 90.00
  },
  "wavelengths": [0.95370],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [32.93,1.08],
    "number_observations_unique": 188303,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 6.37
      },
      {
        "type": "Completeness",
        "value": 95.18
      },
      {
        "type": "Redundancy",
        "value": 6.3
      },
      {
        "type": "CC(1/2)",
        "value": 0.998
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.12,1.081],
      "number_observations_unique": 18272,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 92.71
        },
        {
          "type": "Redundancy",
          "value": 6.2
        },
        {
          "type": "CC(1/2)",
          "value": 0.548
        }
      ]
    }
  ]

}
  

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


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