Data quality metrics extracted from 3g3e.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": "befe97fc30354e0407703458a9e85674",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 51.063,
    "b": 82.584,
    "c": 96.974,
    "alpha": 102.62,
    "beta": 105.43,
    "gamma": 110.79
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50,2.2],
    "number_observations_unique": 61073,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.068
      },
      {
        "type": "Completeness",
        "value": 88.5
      },
      {
        "type": "Redundancy",
        "value": 1.7
      }
    ]
  }
}
  

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


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