Data quality metrics extracted from 3s2j.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": "1d8d7a0972a6108ffb4786ba3af8c8d3",
  "space_group_name": "P 31 2 1",
  "unit_cell": {
    "a": 97.043,
    "b": 97.043,
    "c": 104.962,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [0.97915],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [27.175,1.297],
    "number_observations_unique": 130593,
    "quality_factors": [
      {
        "type": "Completeness",
        "value": 92.52
      }
    ]
  }
}
  

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


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