Data quality metrics extracted from 9m5d.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
  "mxlims_type": "ReflectionSet",
  "version": "0.2.3",
  "uuid": "afec9da5dd1c1d51ffc21a1961ed9578",
  "space_group_name": "I 4 2 2",
  "unit_cell": {
    "a": 173.973,
    "b": 173.973,
    "c": 79.611,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97903],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [123.2,3.57],
    "number_observations_unique": 7538,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.671
      },
      {
        "type": "I/SigI",
        "value": 5.4
      },
      {
        "type": "Completeness",
        "value": 99.63
      },
      {
        "type": "Redundancy",
        "value": 23.7
      },
      {
        "type": "CC(1/2)",
        "value": 0.983
      }
    ]
  }
}
  

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


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