Data quality metrics extracted from 4wdw.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": "fa9f2693c830767ff51d1bba2830beeb",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 55.129,
    "b": 57.917,
    "c": 60.333,
    "alpha": 81.03,
    "beta": 69.72,
    "gamma": 79.11
  },
  "wavelengths": [1.54180],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [56.60,1.94],
    "number_observations_unique": 47421,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 6.9
      },
      {
        "type": "Completeness",
        "value": 93.6
      },
      {
        "type": "Redundancy",
        "value": 2.0
      }
    ]
  }
}
  

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


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