Data quality metrics extracted from 7nzn.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": "f4c9767c89e890ff2fa72832204f9fc0",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 72.91,
    "b": 71.09,
    "c": 80.18,
    "alpha": 90.00,
    "beta": 101.58,
    "gamma": 90.00
  },
  "wavelengths": [0.97950],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [39.92,2.39],
    "number_observations_unique": 15912,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 6.63
      },
      {
        "type": "Completeness",
        "value": 99.24
      },
      {
        "type": "Redundancy",
        "value": 6.0
      },
      {
        "type": "CC(1/2)",
        "value": 0.977
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.475,2.39],
      "number_observations_unique": 1556,
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 2.18
        },
        {
          "type": "Completeness",
          "value": 99.3
        },
        {
          "type": "Redundancy",
          "value": 6.1
        },
        {
          "type": "CC(1/2)",
          "value": 0.454
        }
      ]
    }
  ]

}
  

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


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