Data quality metrics extracted from 8cqk.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": "06064f865222cf303e726df58f2186d4",
  "space_group_name": "P 41 21 2",
  "unit_cell": {
    "a": 93.284,
    "b": 93.284,
    "c": 363.262,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.99999],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [181.63,2.62],
    "number_observations": 742511,
    "number_observations_unique": 49883,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.304
      },
      {
        "type": "R(meas)",
        "value": 0.315
      },
      {
        "type": "R(pim)",
        "value": 0.082
      },
      {
        "type": "I/SigI",
        "value": 7.0
      },
      {
        "type": "Completeness",
        "value": 100.0
      },
      {
        "type": "Redundancy",
        "value": 14.9
      },
      {
        "type": "CC(1/2)",
        "value": 0.995
      }
    ]
  }
}
  

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


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