Data quality metrics extracted from 4drw.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": "c06e290b9dc4aac4a7eb505720de3095",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 47.755,
    "b": 47.791,
    "c": 62.817,
    "alpha": 71.62,
    "beta": 71.63,
    "gamma": 68.62
  },
  "wavelengths": [1.10000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [43.34,3.26],
    "number_observations_unique": 7306,
    "quality_factors": [
      {
        "type": "Completeness",
        "value": 98.60
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.32,3.26],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 100.00
        }
      ]
    }
  ]

}
  

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


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