Data quality metrics extracted from 6w9u.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": "5c5cf53f00f539d2f2d7e7e593c06dca",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 218.317,
    "b": 70.788,
    "c": 142.983,
    "alpha": 90.000,
    "beta": 104.592,
    "gamma": 90.000
  },
  "wavelengths": [0.95360],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [40.11,1.89],
    "number_observations_unique": 168728,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 11.41
      },
      {
        "type": "Completeness",
        "value": 98.79
      },
      {
        "type": "Redundancy",
        "value": 3.8
      },
      {
        "type": "CC(1/2)",
        "value": 0.998
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.958,1.89],
      "number_observations_unique": 16701,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.7
        }
      ]
    }
  ]

}
  

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


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