Data quality metrics extracted from 3cwo.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": "a1cb8a54ab83a925bb4bc3140ee73e54",
  "space_group_name": "P 41 21 2",
  "unit_cell": {
    "a": 108.84,
    "b": 108.84,
    "c": 80.41,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.07100],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [36.,3.10],
    "number_observations_unique": 7947,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.093
      },
      {
        "type": "I/SigI",
        "value": 18.5
      },
      {
        "type": "Completeness",
        "value": 92.3
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.27,3.10],
      "number_observations_unique": 1386,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.549
        },
        {
          "type": "I/SigI",
          "value": 2.4
        },
        {
          "type": "Completeness",
          "value": 94.8
        },
        {
          "type": "Redundancy",
          "value": 13.6
        }
      ]
    }
  ]

}
  

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


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