Data quality metrics extracted from 9qcd.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": "37df007f3038dbfa9965e86df74872e3",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 30.595,
    "b": 82.253,
    "c": 117.764,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [33.7,3.2],
    "number_observations": 56190,
    "number_observations_unique": 4729,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.802
      },
      {
        "type": "I/SigI",
        "value": 3.29
      },
      {
        "type": "Completeness",
        "value": 88.8
      },
      {
        "type": "Redundancy",
        "value": 11.9
      },
      {
        "type": "CC(1/2)",
        "value": 0.94
      }
    ]
  }
}
  

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


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