Data quality metrics extracted from 9gef.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": "e3e566bfedb8e17534686d684f99e728",
  "space_group_name": "P 31 2 1",
  "unit_cell": {
    "a": 158.533,
    "b": 158.533,
    "c": 210.820,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [2.75000,3.14000,3.54000,4.35000,4.50000,5.16000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [210.82,2.37],
    "number_observations_unique": 124385,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.215
      },
      {
        "type": "R(pim)",
        "value": 0.027
      },
      {
        "type": "I/SigI",
        "value": 11.6
      },
      {
        "type": "Completeness",
        "value": 100
      },
      {
        "type": "Redundancy",
        "value": 59.4
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.41,2.37],
      "number_observations_unique": 6112,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 5.369
        },
        {
          "type": "R(pim)",
          "value": 0.796
        },
        {
          "type": "Completeness",
          "value": 100
        },
        {
          "type": "Redundancy",
          "value": 45.0
        },
        {
          "type": "CC(1/2)",
          "value": 0.204
        }
      ]
    }
  ]

}
  

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


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