Data quality metrics extracted from 8r67.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": "166863e0b6aced168bead25b9a029223",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 104.75,
    "b": 158.66,
    "c": 180.28,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.00002],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [49.52,2.20],
    "number_observations_unique": 152380,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.09303
      },
      {
        "type": "R(meas)",
        "value": 0.09666
      },
      {
        "type": "R(pim)",
        "value": 0.02607
      },
      {
        "type": "I/SigI",
        "value": 20.50
      },
      {
        "type": "Completeness",
        "value": 99.90
      },
      {
        "type": "Redundancy",
        "value": 13.6
      },
      {
        "type": "CC(1/2)",
        "value": 1
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.279,2.2],
      "number_observations_unique": 15014,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.611
        },
        {
          "type": "R(meas)",
          "value": 2.718
        },
        {
          "type": "R(pim)",
          "value": 0.7508
        },
        {
          "type": "I/SigI",
          "value": 0.94
        },
        {
          "type": "Completeness",
          "value": 99.41
        },
        {
          "type": "Redundancy",
          "value": 13.0
        },
        {
          "type": "CC(1/2)",
          "value": 0.502
        }
      ]
    }
  ]

}
  

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


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