Data quality metrics extracted from 7gn6.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": "576b0fc92f166fd85f51821619f85c8c",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 67.978,
    "b": 100.764,
    "c": 104.722,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.91788],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [72.610,2.440],
    "number_observations": 119250,
    "number_observations_unique": 17839,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.341
      },
      {
        "type": "R(meas)",
        "value": 0.370
      },
      {
        "type": "R(pim)",
        "value": 0.141
      },
      {
        "type": "I/SigI",
        "value": 4.6
      },
      {
        "type": "Completeness",
        "value": 65.0
      },
      {
        "type": "Redundancy",
        "value": 6.7
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.639,2.440],
      "number_observations": 5818,
      "number_observations_unique": 893,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.361
        },
        {
          "type": "R(meas)",
          "value": 1.477
        },
        {
          "type": "R(pim)",
          "value": 0.566
        },
        {
          "type": "I/SigI",
          "value": 1.4
        },
        {
          "type": "Redundancy",
          "value": 6.5
        }
      ]
    }
  ]

}
  

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


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