Data quality metrics extracted from 7riz.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": "134234cace6d8a090dc0d232a69fcd7b",
  "space_group_name": "P 32 2 1",
  "unit_cell": {
    "a": 48.558,
    "b": 48.558,
    "c": 199.122,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [1.12723],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [33.19,1.71],
    "number_observations_unique": 30590,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.1008
      },
      {
        "type": "R(meas)",
        "value": 0.1036
      },
      {
        "type": "R(pim)",
        "value": 0.02366
      },
      {
        "type": "I/SigI",
        "value": 17.31
      },
      {
        "type": "Completeness",
        "value": 99.31
      },
      {
        "type": "Redundancy",
        "value": 19.5
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.771,1.71],
      "number_observations_unique": 2983,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.421
        },
        {
          "type": "R(meas)",
          "value": 1.458
        },
        {
          "type": "R(pim)",
          "value": 0.323
        },
        {
          "type": "I/SigI",
          "value": 1.65
        },
        {
          "type": "Completeness",
          "value": 98.19
        },
        {
          "type": "Redundancy",
          "value": 20.2
        },
        {
          "type": "CC(1/2)",
          "value": 0.964
        }
      ]
    }
  ]

}
  

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


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