Data quality metrics extracted from 8rtx.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": "17b8c0226ebc33e45874a594320a9984",
  "space_group_name": "P 31",
  "unit_cell": {
    "a": 81.857,
    "b": 81.857,
    "c": 181.927,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [0.96550],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [40.93,2.70],
    "number_observations_unique": 35497,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 9.76
      },
      {
        "type": "Completeness",
        "value": 94.6
      },
      {
        "type": "Redundancy",
        "value": 2.05
      },
      {
        "type": "CC(1/2)",
        "value": 0.998
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.77,2.70],
      "number_observations_unique": 2632,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.616
        }
      ]
    }
  ]

}
  

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


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