Data quality metrics extracted from 9uuf.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
  "mxlims_type": "ReflectionSet",
  "version": "0.2.3",
  "uuid": "9dc7115a2b09b0f789ee35e1ad0f521b",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 192.664,
    "b": 44.476,
    "c": 116.734,
    "alpha": 90.00,
    "beta": 122.75,
    "gamma": 90.00
  },
  "wavelengths": [0.97918],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [49.09,4.37],
    "number_observations_unique": 5575,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 5.8
      },
      {
        "type": "Completeness",
        "value": 98.24
      },
      {
        "type": "Redundancy",
        "value": 3.8
      },
      {
        "type": "CC(1/2)",
        "value": 0.902
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [4.528,4.37],
      "number_observations_unique": 468,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.656
        }
      ]
    }
  ]

}
  

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


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