Data quality metrics extracted from 4hey.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": "8f71d9a8c9f5b4a0fbc83db9164917a4",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 42.418,
    "b": 41.334,
    "c": 71.958,
    "alpha": 90.00,
    "beta": 104.44,
    "gamma": 90.00
  },
  "wavelengths": [0.90000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [19.965,1.450],
    "number_observations_unique": 40399,
    "quality_factors": [

    ]
  }
}
  

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


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