Data quality metrics extracted from 6gko.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": "4a7b304fb8f91de7d933bcca4d0f415e",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 160.701,
    "b": 87.441,
    "c": 68.515,
    "alpha": 90.00,
    "beta": 96.02,
    "gamma": 90.00
  },
  "wavelengths": [0.91800],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [45.494,1.839],
    "number_observations_unique": 80859,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.066
      },
      {
        "type": "I/SigI",
        "value": 12.56
      },
      {
        "type": "Completeness",
        "value": 98.8
      },
      {
        "type": "Redundancy",
        "value": 3.39
      },
      {
        "type": "CC(1/2)",
        "value": 0.998
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.95,1.839],
      "number_observations_unique": 12387,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 93.7
        }
      ]
    }
  ]

}
  

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


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