Data quality metrics extracted from 5xuo.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": "c6fbf15224245ef4fe7492c5c431c28e",
  "space_group_name": "H 3 2",
  "unit_cell": {
    "a": 94.443,
    "b": 94.443,
    "c": 96.975,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [0.97776],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [47.221,2.586],
    "number_observations_unique": 5359,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 7.92
      },
      {
        "type": "Completeness",
        "value": 99.80
      },
      {
        "type": "Redundancy",
        "value": 17.0
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.26,2.59],
      "quality_factors": [

      ]
    }
  ]

}
  

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


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