Data quality metrics extracted from 8axj.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": "7c9514400e617345db6d415e7fe22a9c",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 39.799,
    "b": 52.960,
    "c": 61.433,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97242],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [19.90,1.0],
    "number_observations_unique": 69889,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 10.84
      },
      {
        "type": "Completeness",
        "value": 98.17
      },
      {
        "type": "Redundancy",
        "value": 11.4
      },
      {
        "type": "CC(1/2)",
        "value": 0.998
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.04,1.00],
      "number_observations_unique": 5835,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 83.75
        },
        {
          "type": "CC(1/2)",
          "value": 0.386
        }
      ]
    }
  ]

}
  

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


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