Data quality metrics extracted from 8rt0.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": "fdbd0c9cd6fdd3600002c68431b1c845",
  "space_group_name": "H 3",
  "unit_cell": {
    "a": 76.87,
    "b": 76.87,
    "c": 163.11,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [0.96864],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [51.8,2.19],
    "number_observations_unique": 18479,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.07
      },
      {
        "type": "I/SigI",
        "value": 13.6
      },
      {
        "type": "Completeness",
        "value": 100
      },
      {
        "type": "Redundancy",
        "value": 9.9
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.25,2.19],
      "number_observations_unique": 1322,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.65
        }
      ]
    }
  ]

}
  

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


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