Data quality metrics extracted from 9f80.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": "4acebe4ac75e2af9aa983e4c34531838",
  "space_group_name": "C 2 2 21",
  "unit_cell": {
    "a": 63.04,
    "b": 75.28,
    "c": 139.52,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97860],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [48.378,2.027],
    "number_observations_unique": 21908,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.073
      },
      {
        "type": "I/SigI",
        "value": 22.81
      },
      {
        "type": "Completeness",
        "value": 99.7
      },
      {
        "type": "Redundancy",
        "value": 13.4
      },
      {
        "type": "CC(1/2)",
        "value": 0.732
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.15,2.027],
      "number_observations_unique": 3440,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 1.353
        },
        {
          "type": "Completeness",
          "value": 98.5
        },
        {
          "type": "Redundancy",
          "value": 13.5
        },
        {
          "type": "CC(1/2)",
          "value": 0.681
        }
      ]
    }
  ]

}
  

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


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