Data quality metrics extracted from 9efy.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": "e4fb246aa7d516f067c809867cdf7f80",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 10.32,
    "b": 16.24,
    "c": 21.57,
    "alpha": 67.92,
    "beta": 89.37,
    "gamma": 71.85
  },
  "wavelengths": [0.68880,0.72925],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [14.56,0.91],
    "number_observations_unique": 24651,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 3.95
      },
      {
        "type": "Completeness",
        "value": 92.63
      },
      {
        "type": "Redundancy",
        "value": 2.6
      },
      {
        "type": "CC(1/2)",
        "value": 0.993
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [0.94,0.91],
      "number_observations_unique": 172,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.0247
        }
      ]
    }
  ]

}
  

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


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