Data quality metrics extracted from 6zf2.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": "547f7c4fb631e1c8bb0f237beeb17cdd",
  "space_group_name": "P 61",
  "unit_cell": {
    "a": 104.044,
    "b": 104.044,
    "c": 53.770,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [0.98020],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [46.17,2.20],
    "number_observations_unique": 15811,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.05615
      },
      {
        "type": "R(meas)",
        "value": 0.06986
      },
      {
        "type": "R(pim)",
        "value": 0.04098
      },
      {
        "type": "I/SigI",
        "value": 11.82
      },
      {
        "type": "Completeness",
        "value": 92.74
      },
      {
        "type": "Redundancy",
        "value": 2.6
      },
      {
        "type": "CC(1/2)",
        "value": 0.996
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.282,2.203],
      "number_observations_unique": 1624,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.4506
        },
        {
          "type": "R(meas)",
          "value": 0.5601
        },
        {
          "type": "R(pim)",
          "value": 0.328
        },
        {
          "type": "I/SigI",
          "value": 2.10
        },
        {
          "type": "Completeness",
          "value": 95.75
        },
        {
          "type": "Redundancy",
          "value": 2.6
        },
        {
          "type": "CC(1/2)",
          "value": 0.861
        }
      ]
    }
  ]

}
  

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


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