Data quality metrics extracted from 9zfx.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": "71a3aafecbb04f9f8992688e17b80838",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 50.409,
    "b": 136.498,
    "c": 129.548,
    "alpha": 90.00,
    "beta": 100.85,
    "gamma": 90.00
  },
  "wavelengths": [0.97911],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [34.54,2.33],
    "number_observations_unique": 95755,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 1.56
      },
      {
        "type": "Completeness",
        "value": 96.2
      },
      {
        "type": "Redundancy",
        "value": 6.5
      },
      {
        "type": "CC(1/2)",
        "value": 0.984
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.36,2.33],
      "number_observations_unique": 3113,
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 0.73
        },
        {
          "type": "CC(1/2)",
          "value": 0.331
        }
      ]
    }
  ]

}
  

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


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