Data quality metrics extracted from 5i36.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": "27e0fd63033440e9b7f5828ec52c1e1f",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 67.530,
    "b": 69.131,
    "c": 70.106,
    "alpha": 98.19,
    "beta": 97.34,
    "gamma": 99.74
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [33.6,5.1],
    "number_observations_unique": 4725,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.902
      },
      {
        "type": "I/SigI",
        "value": 9.77
      },
      {
        "type": "Completeness",
        "value": 96.4
      },
      {
        "type": "Redundancy",
        "value": 3.6
      }
    ]
  }
}
  

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


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