Data quality metrics extracted from 2qsf.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": "d939fc2a376b0c12266197d408851433",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 83.167,
    "b": 115.711,
    "c": 113.947,
    "alpha": 90.0,
    "beta": 105.7,
    "gamma": 90.0
  },
  "wavelengths": [0.97922],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [15,2.35],
    "number_observations_unique": 41336,
    "quality_factors": [

    ]
  }
}
  

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


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