Data quality metrics extracted from 2z04.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": "bfc3fc71c156e91db3e8c5816a4750c3",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 51.291,
    "b": 55.053,
    "c": 74.541,
    "alpha": 93.93,
    "beta": 101.54,
    "gamma": 114.23
  },
  "wavelengths": [0.97890,0.97930,0.90000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [32.41,2.35],
    "number_observations_unique": 56281,
    "quality_factors": [
      {
        "type": "Completeness",
        "value": 94.0
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.50,2.35],
      "number_observations_unique": 8627,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 86.0
        }
      ]
    }
  ]

}
  

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


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