Data quality metrics extracted from 8g8n.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": "9486288b4b7111eb5c6d8ffe5cb21cd4",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 72.43,
    "b": 203.51,
    "c": 225.52,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.54000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [20.03,3.0],
    "number_observations_unique": 66307,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.2699
      },
      {
        "type": "R(meas)",
        "value": 0.3218
      },
      {
        "type": "R(pim)",
        "value": 0.1727
      },
      {
        "type": "I/SigI",
        "value": 4.08
      },
      {
        "type": "Completeness",
        "value": 97.83
      },
      {
        "type": "Redundancy",
        "value": 3.3
      },
      {
        "type": "CC(1/2)",
        "value": 0.963
      }
    ]
  }
}
  

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


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