Data quality metrics extracted from 2zjk.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": "a55cdb89a111fd632c7749ac981c3cd5",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 233.149,
    "b": 108.546,
    "c": 64.091,
    "alpha": 90.00,
    "beta": 103.34,
    "gamma": 90.00
  },
  "wavelengths": [1.54000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [20,2.8],
    "number_observations_unique": 37401,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.104
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.9,2.8],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.555
        }
      ]
    }
  ]

}
  

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


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