Data quality metrics extracted from 6w9m.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": "438c0c2c99aafe7a55ed59b8a782718a",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 87.065,
    "b": 52.854,
    "c": 69.646,
    "alpha": 90.000,
    "beta": 116.394,
    "gamma": 90.000
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [38.995,1.586],
    "number_observations_unique": 38375,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 10.9
      },
      {
        "type": "Completeness",
        "value": 96.6
      },
      {
        "type": "Redundancy",
        "value": 5.5
      },
      {
        "type": "CC(1/2)",
        "value": 0.921
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.64,1.586],
      "number_observations_unique": 3352,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.684
        }
      ]
    }
  ]

}
  

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


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