Data quality metrics extracted from 9rjt.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
  "mxlims_type": "ReflectionSet",
  "version": "0.2.3",
  "uuid": "73b8416ae73bd2cd1419ea2d1be7f47c",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 64.993,
    "b": 124.845,
    "c": 150.480,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.96770],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [64.442,1.830],
    "number_observations_unique": 73531,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 8.518
      },
      {
        "type": "Completeness",
        "value": 88.57
      },
      {
        "type": "Redundancy",
        "value": 8.53
      },
      {
        "type": "CC(1/2)",
        "value": 0.9887
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.988,1.830],
      "number_observations_unique": 3677,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.4894
        }
      ]
    }
  ]

}
  

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


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