Data quality metrics extracted from 3c2g.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": "75a3b69cf277e6e71459fb4e8e8928cd",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 84.969,
    "b": 85.343,
    "c": 93.657,
    "alpha": 65.22,
    "beta": 78.08,
    "gamma": 83.02
  },
  "wavelengths": [0.97920],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50,2.5],
    "number_observations_unique": 75516,
    "quality_factors": [
      {
        "type": "Completeness",
        "value": 93.7
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.59,2.5],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 72.8
        }
      ]
    }
  ]

}
  

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


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