Data quality metrics extracted from 5qd1.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": "46b02e2b76767577da44c1ddc202cd2b",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 82.849,
    "b": 104.217,
    "c": 100.832,
    "alpha": 90.00,
    "beta": 104.37,
    "gamma": 90.00
  },
  "wavelengths": [1.54178],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [80.257,2.400],
    "number_observations_unique": 64959,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.061
      },
      {
        "type": "Completeness",
        "value": 99.9
      }
    ]
  }
}
  

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


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