Data quality metrics extracted from 1gdn.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": "6a5fe3ae9ce5c83ce932987643696c24",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 33.156,
    "b": 36.763,
    "c": 39.616,
    "alpha": 102.19,
    "beta": 104.70,
    "gamma": 102.91
  },
  "wavelengths": [0.84680],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [20,0.81],
    "number_observations_unique": 700099,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.03
      },
      {
        "type": "I/SigI",
        "value": 1.8
      },
      {
        "type": "Completeness",
        "value": 90.9
      },
      {
        "type": "Redundancy",
        "value": 4.5
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [0.82,0.81],
      "number_observations_unique": 7019,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.267
        },
        {
          "type": "Completeness",
          "value": 81.9
        },
        {
          "type": "Redundancy",
          "value": 1.8
        }
      ]
    }
  ]

}
  

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


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