Data quality metrics extracted from 5ud4.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": "41880a57119efdec944ebbff09337598",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 39.391,
    "b": 62.590,
    "c": 64.817,
    "alpha": 81.98,
    "beta": 75.74,
    "gamma": 74.23
  },
  "wavelengths": [1.10000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [45.135,1.5],
    "number_observations_unique": 83963,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.07638
      },
      {
        "type": "I/SigI",
        "value": 7.07
      },
      {
        "type": "Completeness",
        "value": 86.23
      },
      {
        "type": "Redundancy",
        "value": 1.8
      },
      {
        "type": "CC(1/2)",
        "value": 0.985
      }
    ]
  }
}
  

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


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