Data quality metrics extracted from 6z7y.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": "ec42d74d536f0cf26eef35b1680f79ae",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 110.39,
    "b": 173.23,
    "c": 83.80,
    "alpha": 90.000,
    "beta": 135.829,
    "gamma": 90.000
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [48.42,2.2],
    "number_observations_unique": 54923,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.09194
      },
      {
        "type": "R(meas)",
        "value": 0.1098
      },
      {
        "type": "R(pim)",
        "value": 0.05942
      },
      {
        "type": "I/SigI",
        "value": 8.88
      },
      {
        "type": "Completeness",
        "value": 99.02
      },
      {
        "type": "Redundancy",
        "value": 3.4
      },
      {
        "type": "CC(1/2)",
        "value": 0.993
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.279,2.2],
      "number_observations_unique": 19188,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.8584
        },
        {
          "type": "R(meas)",
          "value": 1.016
        },
        {
          "type": "R(pim)",
          "value": 0.5396
        },
        {
          "type": "I/SigI",
          "value": 1.37
        },
        {
          "type": "Completeness",
          "value": 99.59
        },
        {
          "type": "Redundancy",
          "value": 3.5
        },
        {
          "type": "CC(1/2)",
          "value": 0.549
        }
      ]
    }
  ]

}
  

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


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