Data quality metrics extracted from 7fhd.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": "59641975b14cccfaa0f7f4b0fd03b8f3",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 44.286,
    "b": 75.162,
    "c": 87.605,
    "alpha": 89.939,
    "beta": 89.903,
    "gamma": 89.996
  },
  "wavelengths": [0.95373],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [29.200,3.500],
    "number_observations": 29344,
    "number_observations_unique": 13654,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.262
      },
      {
        "type": "R(meas)",
        "value": 0.339
      },
      {
        "type": "R(pim)",
        "value": 0.211
      },
      {
        "type": "I/SigI",
        "value": 2.200
      },
      {
        "type": "Completeness",
        "value": 95.800
      },
      {
        "type": "Redundancy",
        "value": 2.100
      },
      {
        "type": "CC(1/2)",
        "value": 0.914
      }
    ]
  }
}
  

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


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