Data quality metrics extracted from 8xis.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": "a16cd53c2ddf3f27d352404596d93517",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 82.277,
    "b": 88.520,
    "c": 88.540,
    "alpha": 98.407,
    "beta": 110.691,
    "gamma": 110.652
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [43.44,1.68],
    "number_observations_unique": 229962,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 13.69
      },
      {
        "type": "Completeness",
        "value": 96.99
      },
      {
        "type": "Redundancy",
        "value": 3.5
      },
      {
        "type": "CC(1/2)",
        "value": 1
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.74,1.68],
      "number_observations_unique": 22646,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.516
        }
      ]
    }
  ]

}
  

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


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