Data quality metrics extracted from 1xpq.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": "01f06cfdeb57c666a8010e362db75000",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 103.048,
    "b": 98.133,
    "c": 123.832,
    "alpha": 90.00,
    "beta": 103.28,
    "gamma": 90.00
  },
  "wavelengths": [0.94740],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50,2.50],
    "number_observations_unique": 66331,
    "quality_factors": [

    ]
  }
}
  

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


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