Data quality metrics extracted from 3cjw.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": "0f19ea634383c9e2e48419e1dc3133d8",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 97.854,
    "b": 47.762,
    "c": 43.128,
    "alpha": 90.00,
    "beta": 100.87,
    "gamma": 90.00
  },
  "wavelengths": [0.70000,1.00000,1.40000,1.80000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50.00,1.48],
    "number_observations_unique": 32718,
    "quality_factors": [

    ]
  }
}
  

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


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