Data quality metrics extracted from 3sbr.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": "f4cbab9dd6a9531f27c83a6e7a1d145d",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 96.577,
    "b": 106.453,
    "c": 130.876,
    "alpha": 111.45,
    "beta": 107.22,
    "gamma": 90.72
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [95.05,2.24],
    "number_observations_unique": 194872,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.090
      },
      {
        "type": "I/SigI",
        "value": 12.8
      },
      {
        "type": "Completeness",
        "value": 94.6
      },
      {
        "type": "Redundancy",
        "value": 3.8
      }
    ]
  }
}
  

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


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