Data quality metrics extracted from 7fhu.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": "2ba0b1e09ed48f84f44d8f2ccc946969",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 44.022,
    "b": 66.804,
    "c": 103.120,
    "alpha": 90.000,
    "beta": 94.386,
    "gamma": 90.000
  },
  "wavelengths": [1.54180],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [43.89,2.43],
    "number_observations_unique": 22678,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.1232
      },
      {
        "type": "I/SigI",
        "value": 19.97
      },
      {
        "type": "Completeness",
        "value": 100
      },
      {
        "type": "Redundancy",
        "value": 17.66
      },
      {
        "type": "CC(1/2)",
        "value": 0.998
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.53,2.43],
      "number_observations_unique": 2531,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.4421
        },
        {
          "type": "I/SigI",
          "value": 5.11
        },
        {
          "type": "Completeness",
          "value": 100
        },
        {
          "type": "Redundancy",
          "value": 11.4
        },
        {
          "type": "CC(1/2)",
          "value": 0.948
        }
      ]
    }
  ]

}
  

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


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