Data quality metrics extracted from 6zf5.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": "c77876c9d1fe946b736fb58fcd631fdf",
  "space_group_name": "P 61",
  "unit_cell": {
    "a": 103.189,
    "b": 103.189,
    "c": 54.917,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [0.97625],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [51.59,1.29],
    "number_observations_unique": 82576,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.04714
      },
      {
        "type": "R(meas)",
        "value": 0.04839
      },
      {
        "type": "R(pim)",
        "value": 0.01084
      },
      {
        "type": "I/SigI",
        "value": 29.81
      },
      {
        "type": "Completeness",
        "value": 99.62
      },
      {
        "type": "Redundancy",
        "value": 18.9
      },
      {
        "type": "CC(1/2)",
        "value": 1
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.341,1.295],
      "number_observations_unique": 7943,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.6923
        },
        {
          "type": "R(meas)",
          "value": 0.726
        },
        {
          "type": "R(pim)",
          "value": 0.2142
        },
        {
          "type": "I/SigI",
          "value": 2.71
        },
        {
          "type": "Completeness",
          "value": 96.37
        },
        {
          "type": "Redundancy",
          "value": 11.1
        },
        {
          "type": "CC(1/2)",
          "value": 0.913
        }
      ]
    }
  ]

}
  

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


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