Data quality metrics extracted from 7u3r.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": "7163c50aad28159a9e9fa6b71bd36300",
  "space_group_name": "H 3",
  "unit_cell": {
    "a": 157.548,
    "b": 157.548,
    "c": 133.470,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [1.00743],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [95.410,6.27],
    "number_observations_unique": 1834,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 12.6
      },
      {
        "type": "Completeness",
        "value": 85.0
      },
      {
        "type": "Redundancy",
        "value": 10.9
      },
      {
        "type": "CC(1/2)",
        "value": 1.000
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [7.135,6.27],
      "number_observations_unique": 203,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 51.5
        },
        {
          "type": "CC(1/2)",
          "value": 0.089
        }
      ]
    },
    {
      "resolution_limits": [95.410,14.912],
      "number_observations_unique": 202,
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 100.0
        },
        {
          "type": "CC(1/2)",
          "value": 0.999
        }
      ]
    }
  ]

}
  

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


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