Data quality metrics extracted from 4rui.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": "cd0f98183e4d33cda5e2027293ef04f0",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 62.74,
    "b": 132.97,
    "c": 133.03,
    "alpha": 62.40,
    "beta": 99.06,
    "gamma": 80.93
  },
  "wavelengths": [0.97000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [113.76,2.61],
    "number_observations_unique": 110464,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.11
      },
      {
        "type": "I/SigI",
        "value": 4.7
      },
      {
        "type": "Completeness",
        "value": 90.2
      },
      {
        "type": "Redundancy",
        "value": 3.53
      }
    ]
  }
}
  

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


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