Data quality metrics extracted from 3fzn.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": "f7515682727cd34aefe92d3ac9cc8274",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 71.510,
    "b": 93.344,
    "c": 94.525,
    "alpha": 63.46,
    "beta": 72.82,
    "gamma": 73.21
  },
  "wavelengths": [1.05000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [20,1.6],
    "number_observations_unique": 243335,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.107
      },
      {
        "type": "Completeness",
        "value": 93.2
      },
      {
        "type": "Redundancy",
        "value": 1.83
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.64,1.62],
      "number_observations_unique": 9621,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.39
        },
        {
          "type": "I/SigI",
          "value": 2.1
        },
        {
          "type": "Completeness",
          "value": 92.3
        },
        {
          "type": "Redundancy",
          "value": 1.82
        }
      ]
    }
  ]

}
  

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


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