Data quality metrics extracted from 7vuw.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": "591036042d84c2a891c2584b0ea263e5",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 182.076,
    "b": 204.481,
    "c": 177.680,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.90000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [200.0,1.60],
    "number_observations_unique": 859689,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.095
      },
      {
        "type": "R(pim)",
        "value": 0.023
      },
      {
        "type": "I/SigI",
        "value": 43.9
      },
      {
        "type": "Completeness",
        "value": 100.0
      },
      {
        "type": "Redundancy",
        "value": 16.9
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.61,1.60],
      "number_observations_unique": 21340,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.314
        },
        {
          "type": "R(pim)",
          "value": 0.339
        },
        {
          "type": "I/SigI",
          "value": 3.5
        },
        {
          "type": "Redundancy",
          "value": 15.7
        }
      ]
    }
  ]

}
  

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


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