Data quality metrics extracted from 8brh.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": "7072a91e4ce4d693e70d7f2fe703e9e1",
  "space_group_name": "P 31 2 1",
  "unit_cell": {
    "a": 128.48,
    "b": 128.48,
    "c": 77.54,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [1.15120],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [49.47,2.4],
    "number_observations_unique": 29225,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.1406
      },
      {
        "type": "R(meas)",
        "value": 0.1502
      },
      {
        "type": "I/SigI",
        "value": 10.05
      },
      {
        "type": "Completeness",
        "value": 99.9
      },
      {
        "type": "Redundancy",
        "value": 8.1
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.54,2.4],
      "number_observations_unique": 4655,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 99.8
        },
        {
          "type": "CC(1/2)",
          "value": 0.465
        }
      ]
    }
  ]

}
  

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


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