Data quality metrics extracted from 3wgx.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": "32b9b9248dedf87b59977ed078c9f3af",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 35.098,
    "b": 36.406,
    "c": 40.594,
    "alpha": 81.17,
    "beta": 87.47,
    "gamma": 85.40
  },
  "wavelengths": [0.90000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [26.785,0.92],
    "number_observations_unique": 126561,
    "quality_factors": [
      {
        "type": "Completeness",
        "value": 89.9
      },
      {
        "type": "Redundancy",
        "value": 2.0
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [0.94,0.92],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 62.3
        }
      ]
    }
  ]

}
  

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


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