Data quality metrics extracted from 9wwh.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": "793e020d3529fd1c568fe4075c3b4e48",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 52.442,
    "b": 162.561,
    "c": 188.189,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97902],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50,3.5],
    "number_observations_unique": 18337,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 17.3
      },
      {
        "type": "Completeness",
        "value": 87.62
      },
      {
        "type": "Redundancy",
        "value": 8.0
      },
      {
        "type": "CC(1/2)",
        "value": 0.975
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.637,3.511],
      "number_observations_unique": 1535,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 76.03
        },
        {
          "type": "CC(1/2)",
          "value": 0.476
        }
      ]
    }
  ]

}
  

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


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