Data quality metrics extracted from 7aze.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": "995a012399cdeb6d4a6c5fc265a3eb4e",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 63.50,
    "b": 64.81,
    "c": 71.10,
    "alpha": 106.71,
    "beta": 100.07,
    "gamma": 116.95
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [53.86,1.82],
    "number_observations_unique": 60806,
    "quality_factors": [
      {
        "type": "R(pim)",
        "value": 0.091
      },
      {
        "type": "I/SigI",
        "value": 8.5
      },
      {
        "type": "Completeness",
        "value": 90.3
      },
      {
        "type": "Redundancy",
        "value": 6
      },
      {
        "type": "CC(1/2)",
        "value": 0.993
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.99,1.82],
      "number_observations_unique": 3041,
      "quality_factors": [
        {
          "type": "R(pim)",
          "value": 1.154
        },
        {
          "type": "I/SigI",
          "value": 1.3
        },
        {
          "type": "CC(1/2)",
          "value": 0.844
        }
      ]
    }
  ]

}
  

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


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