Data quality metrics extracted from 6ywf.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": "b160ef20fd207186848048fc37f633e3",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 34.768,
    "b": 80.442,
    "c": 81.375,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97600],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [40.22,1.9],
    "number_observations_unique": 18624,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.07987
      },
      {
        "type": "R(meas)",
        "value": 0.08505
      },
      {
        "type": "R(pim)",
        "value": 0.02868
      },
      {
        "type": "I/SigI",
        "value": 17.26
      },
      {
        "type": "Completeness",
        "value": 98.32
      },
      {
        "type": "Redundancy",
        "value": 8.5
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.968,1.9],
      "number_observations_unique": 11623,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.338
        },
        {
          "type": "R(meas)",
          "value": 0.3682
        },
        {
          "type": "R(pim)",
          "value": 0.1418
        },
        {
          "type": "I/SigI",
          "value": 4.94
        },
        {
          "type": "Completeness",
          "value": 93.09
        },
        {
          "type": "Redundancy",
          "value": 6.5
        },
        {
          "type": "CC(1/2)",
          "value": 0.947
        }
      ]
    }
  ]

}
  

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


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