Data quality metrics extracted from 8rwr.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": "0584d823b28e4546f41b3e229581c01f",
  "space_group_name": "P 21 21 2",
  "unit_cell": {
    "a": 60.213,
    "b": 79.455,
    "c": 55.679,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.81531],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [39.73,1.03],
    "number_observations_unique": 130263,
    "quality_factors": [
      {
        "type": "R(pim)",
        "value": 0.031
      },
      {
        "type": "I/SigI",
        "value": 9.6
      },
      {
        "type": "Completeness",
        "value": 98.5
      },
      {
        "type": "Redundancy",
        "value": 13.6
      },
      {
        "type": "CC(1/2)",
        "value": 1.000
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.05,1.03],
      "number_observations_unique": 6249,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 1.104
        },
        {
          "type": "I/SigI",
          "value": 0.3
        },
        {
          "type": "CC(1/2)",
          "value": 0.347
        }
      ]
    }
  ]

}
  

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


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