Data quality metrics extracted from 7qdn.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": "c23784ce5ad4892ecbd4cc22fe49f5fa",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 207.448,
    "b": 112.687,
    "c": 188.333,
    "alpha": 90.00,
    "beta": 91.36,
    "gamma": 90.00
  },
  "wavelengths": [0.91589],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [103.695,1.695],
    "number_observations_unique": 447443,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.095
      },
      {
        "type": "I/SigI",
        "value": 14.500
      },
      {
        "type": "Completeness",
        "value": 93.500
      },
      {
        "type": "Redundancy",
        "value": 15.300
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.725,1.695],
      "number_observations_unique": 22972,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 4.784
        },
        {
          "type": "I/SigI",
          "value": 0.500
        },
        {
          "type": "Completeness",
          "value": 96.300
        },
        {
          "type": "Redundancy",
          "value": 13.400
        }
      ]
    }
  ]

}
  

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


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