Data quality metrics extracted from 6r4h.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": "a33e8dfc2308fb4fc151ca401d5c8c0f",
  "space_group_name": "P 41 21 2",
  "unit_cell": {
    "a": 154.073,
    "b": 154.073,
    "c": 162.926,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [48.982,2.24],
    "number_observations_unique": 93589,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 16.87
      },
      {
        "type": "Completeness",
        "value": 99.7
      },
      {
        "type": "Redundancy",
        "value": 7.4
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.32,2.24],
      "number_observations_unique": 9028,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.627
        }
      ]
    }
  ]

}
  

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


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