Data quality metrics extracted from 7t47.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": "79ad385c5c07bc736b6a4d483018ed2c",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 40.311,
    "b": 50.579,
    "c": 92.903,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97918],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [46.4515,1.27],
    "number_observations_unique": 48107,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.04256
      },
      {
        "type": "R(pim)",
        "value": 0.01824
      },
      {
        "type": "I/SigI",
        "value": 26.3
      },
      {
        "type": "Completeness",
        "value": 94.48
      },
      {
        "type": "Redundancy",
        "value": 6.5
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.315,1.27],
      "number_observations_unique": 27847,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.1862
        },
        {
          "type": "R(pim)",
          "value": 0.07941
        },
        {
          "type": "Completeness",
          "value": 88.63
        },
        {
          "type": "CC(1/2)",
          "value": 0.984
        }
      ]
    }
  ]

}
  

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


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