Data quality metrics extracted from 7zqy.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": "38e6bda92a57674f34af8f75ccfcee23",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 43.49,
    "b": 53.97,
    "c": 110.42,
    "alpha": 75.85,
    "beta": 78.74,
    "gamma": 90.00
  },
  "wavelengths": [1.28320],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [104.88,2.51],
    "number_observations_unique": 63401,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.078
      },
      {
        "type": "I/SigI",
        "value": 7.86
      },
      {
        "type": "Completeness",
        "value": 97.4
      },
      {
        "type": "Redundancy",
        "value": 3.55
      },
      {
        "type": "CC(1/2)",
        "value": 0.93
      }
    ]
  }
}
  

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


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