Data quality metrics extracted from 9qex.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": "bfb34d7c3a9fba8b69ee43e502c7a7a6",
  "space_group_name": "P 43 21 2",
  "unit_cell": {
    "a": 111.328,
    "b": 111.328,
    "c": 242.725,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.88560],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [101.192,1.90],
    "number_observations_unique": 86444,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.256
      },
      {
        "type": "R(meas)",
        "value": 0.272
      },
      {
        "type": "R(pim)",
        "value": 0.090
      },
      {
        "type": "I/SigI",
        "value": 6.7
      },
      {
        "type": "Completeness",
        "value": 93.3
      },
      {
        "type": "Redundancy",
        "value": 9.1
      },
      {
        "type": "CC(1/2)",
        "value": 0.977
      }
    ]
  }
}
  

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


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