Data quality metrics extracted from 7geg.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": "98a044dcb124df43541066e9c0197929",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 113.858,
    "b": 53.627,
    "c": 44.761,
    "alpha": 90.00,
    "beta": 101.28,
    "gamma": 90.00
  },
  "wavelengths": [0.91261],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [55.82,1.73],
    "number_observations": 89210,
    "number_observations_unique": 27773,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.103
      },
      {
        "type": "R(meas)",
        "value": 0.124
      },
      {
        "type": "R(pim)",
        "value": 0.068
      },
      {
        "type": "I/SigI",
        "value": 7.7
      },
      {
        "type": "Completeness",
        "value": 99.7
      },
      {
        "type": "Redundancy",
        "value": 3.2
      },
      {
        "type": "CC(1/2)",
        "value": 0.952
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.76,1.73],
      "number_observations": 5005,
      "number_observations_unique": 1504,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.709
        },
        {
          "type": "R(meas)",
          "value": 2.038
        },
        {
          "type": "R(pim)",
          "value": 1.099
        },
        {
          "type": "I/SigI",
          "value": 0.5
        },
        {
          "type": "Redundancy",
          "value": 3.3
        },
        {
          "type": "CC(1/2)",
          "value": 0.301
        }
      ]
    }
  ]

}
  

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


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