Data quality metrics extracted from 8rpj.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": "c9892bf21f6f93c429eeac664865b4cd",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 185.196,
    "b": 105.169,
    "c": 193.605,
    "alpha": 90.00,
    "beta": 96.51,
    "gamma": 90.00
  },
  "wavelengths": [0.97625],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [84.34,1.90],
    "number_observations_unique": 286766,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.125
      },
      {
        "type": "I/SigI",
        "value": 10
      },
      {
        "type": "Completeness",
        "value": 99.3
      },
      {
        "type": "Redundancy",
        "value": 6.8
      },
      {
        "type": "CC(1/2)",
        "value": 0.994
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.935,1.90],
      "number_observations_unique": 14248,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 1.04
        },
        {
          "type": "I/SigI",
          "value": 2
        },
        {
          "type": "Completeness",
          "value": 99
        },
        {
          "type": "Redundancy",
          "value": 7
        },
        {
          "type": "CC(1/2)",
          "value": 0.71
        }
      ]
    }
  ]

}
  

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


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