Data quality metrics extracted from 1ozn.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": "6c2b032fb4424b3f1438c53e42853e5e",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 32.206,
    "b": 33.915,
    "c": 60.221,
    "alpha": 85.02,
    "beta": 75.91,
    "gamma": 67.96
  },
  "wavelengths": [1.00640,1.00960,0.99500],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50,1.52],
    "number_observations_unique": 33484,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.053
      },
      {
        "type": "I/SigI",
        "value": 34.0
      },
      {
        "type": "Completeness",
        "value": 96.6
      },
      {
        "type": "Redundancy",
        "value": 14.4
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.56,1.52],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.214
        },
        {
          "type": "I/SigI",
          "value": 7.4
        },
        {
          "type": "Completeness",
          "value": 96.4
        },
        {
          "type": "Redundancy",
          "value": 13.8
        }
      ]
    }
  ]

}
  

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


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