Data quality metrics extracted from 4u3o.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": "55526d2538f0d1bc9abdbe8902557590",
  "space_group_name": "H 3",
  "unit_cell": {
    "a": 46.328,
    "b": 46.328,
    "c": 58.075,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [1.37000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [23.16,1.8],
    "number_observations_unique": 4140,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.05784
      },
      {
        "type": "I/SigI",
        "value": 43.26
      },
      {
        "type": "Completeness",
        "value": 95.74
      },
      {
        "type": "Redundancy",
        "value": 19.0
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.843,1.800],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.2178
        },
        {
          "type": "I/SigI",
          "value": 12.06
        },
        {
          "type": "Completeness",
          "value": 79.91
        },
        {
          "type": "Redundancy",
          "value": 11.4
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell
Low resolution limit [Å] 23.160 1.843
High resolution limit [Å] 1.800 1.800
R(merge) 0.0578 0.2178
Completeness [%] 95.7 79.9
Multiplicity 19.0 11.4


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

Resolution [Å] R(merge) Completeness [%] Multiplicity
1.843-1.800 0.2178 79.9 11.4