Data quality metrics extracted from 6zly.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": "f533a79b94c2039de21650be469800bc",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 92.89,
    "b": 60.07,
    "c": 118.02,
    "alpha": 90.00,
    "beta": 103.34,
    "gamma": 90.00
  },
  "wavelengths": [0.97300],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [57.418,1.79],
    "number_observations_unique": 57534,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.056
      },
      {
        "type": "I/SigI",
        "value": 7.9
      },
      {
        "type": "Completeness",
        "value": 96.5
      },
      {
        "type": "Redundancy",
        "value": 3.2
      },
      {
        "type": "CC(1/2)",
        "value": 0.998
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.83,1.79],
      "number_observations_unique": 3404,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.138
        },
        {
          "type": "CC(1/2)",
          "value": 0.425
        }
      ]
    }
  ]

}
  

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


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