Data quality metrics extracted from 5b5n.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": "2caa3c15c8490d464f93c63492027431",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 163.83,
    "b": 148.56,
    "c": 210.00,
    "alpha": 90.0,
    "beta": 108.1,
    "gamma": 90.0
  },
  "wavelengths": [0.98000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [49.90,3.30],
    "number_observations_unique": 133051,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 8.6
      },
      {
        "type": "Completeness",
        "value": 93
      },
      {
        "type": "Redundancy",
        "value": 22.8
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.36,3.30],
      "quality_factors": [

      ]
    }
  ]

}
  

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


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