Data quality metrics extracted from 7p59.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": "81164d895125d723f0e538659ffbb6f1",
  "space_group_name": "I 21 3",
  "unit_cell": {
    "a": 129.155,
    "b": 129.155,
    "c": 129.155,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [45.66,1.270],
    "number_observations_unique": 93285,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.08937
      },
      {
        "type": "R(meas)",
        "value": 0.0917
      },
      {
        "type": "R(pim)",
        "value": 0.02045
      },
      {
        "type": "I/SigI",
        "value": 21.27
      },
      {
        "type": "Completeness",
        "value": 99.94
      },
      {
        "type": "Redundancy",
        "value": 19.9
      },
      {
        "type": "CC(1/2)",
        "value": 1
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.318,1.270],
      "number_observations_unique": 9281,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.497
        },
        {
          "type": "R(meas)",
          "value": 2.565
        },
        {
          "type": "R(pim)",
          "value": 0.5849
        },
        {
          "type": "I/SigI",
          "value": 1.28
        },
        {
          "type": "Completeness",
          "value": 99.66
        },
        {
          "type": "Redundancy",
          "value": 19.1
        },
        {
          "type": "CC(1/2)",
          "value": 0.513
        }
      ]
    }
  ]

}
  

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


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