Data quality metrics extracted from 6oxn.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": "60292116130f6fc69ced4cadba550037",
  "space_group_name": "P 65 2 2",
  "unit_cell": {
    "a": 158.96,
    "b": 158.96,
    "c": 94.54,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [0.97856],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [79.480,2.61],
    "number_observations_unique": 21320,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.7276
      },
      {
        "type": "R(pim)",
        "value": 0.1151
      },
      {
        "type": "I/SigI",
        "value": 82.87
      },
      {
        "type": "Completeness",
        "value": 97.03
      },
      {
        "type": "Redundancy",
        "value": 37.1
      },
      {
        "type": "CC(1/2)",
        "value": 0.887
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.6753,2.6100],
      "number_observations_unique": 2100,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 97.90
        }
      ]
    }
  ]

}
  

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


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