Data quality metrics extracted from 7z9j.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": "8dadab9ce39787e8a20c0128a7c659ba",
  "space_group_name": "P 65 2 2",
  "unit_cell": {
    "a": 79.772,
    "b": 79.772,
    "c": 137.872,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [0.91160],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [48.80,1.90],
    "number_observations_unique": 21195,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.259
      },
      {
        "type": "R(meas)",
        "value": 0.266
      },
      {
        "type": "R(pim)",
        "value": 0.058
      },
      {
        "type": "I/SigI",
        "value": 14.3
      },
      {
        "type": "Completeness",
        "value": 100.0
      },
      {
        "type": "Redundancy",
        "value": 38.9
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [48.80,9.11],
      "number_observations_unique": 261,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.149
        },
        {
          "type": "R(meas)",
          "value": 0.153
        },
        {
          "type": "R(pim)",
          "value": 0.034
        },
        {
          "type": "Redundancy",
          "value": 27.7
        },
        {
          "type": "CC(1/2)",
          "value": 0.999
        }
      ]
    },
    {
      "resolution_limits": [1.94,1.90],
      "number_observations_unique": 1325,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 5.046
        },
        {
          "type": "R(meas)",
          "value": 5.174
        },
        {
          "type": "R(pim)",
          "value": 1.142
        },
        {
          "type": "Redundancy",
          "value": 38.5
        },
        {
          "type": "CC(1/2)",
          "value": 0.726
        }
      ]
    }
  ]

}
  

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


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