Data quality metrics extracted from 9qn6.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": "e82591af0b01b046c2d0d77bd999256f",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 76.31,
    "b": 65.39,
    "c": 77.42,
    "alpha": 90.00,
    "beta": 91.39,
    "gamma": 90.00
  },
  "wavelengths": [0.97980],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [49.95,2.3],
    "number_observations_unique": 33269,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 13.44
      },
      {
        "type": "Completeness",
        "value": 94.27
      },
      {
        "type": "Redundancy",
        "value": 2.9
      },
      {
        "type": "CC(1/2)",
        "value": 0.995
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.38,2.3],
      "number_observations_unique": 3373,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.914
        }
      ]
    }
  ]

}
  

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


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