Data quality metrics extracted from 3pn7.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": "8ca33cad471c10a98871a98170d99fa9",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 50.737,
    "b": 68.779,
    "c": 79.305,
    "alpha": 77.41,
    "beta": 85.94,
    "gamma": 73.61
  },
  "wavelengths": [1.07500],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50,2.24],
    "number_observations_unique": 46183,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.074
      },
      {
        "type": "I/SigI",
        "value": 16.9
      },
      {
        "type": "Completeness",
        "value": 96.2
      },
      {
        "type": "Redundancy",
        "value": 3.6
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.33,2.24],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 82.0
        }
      ]
    }
  ]

}
  

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


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