Data quality metrics extracted from 2iq5.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": "f728b22ef9934989ba1c5595855fa0ca",
  "space_group_name": "H 3",
  "unit_cell": {
    "a": 151.66,
    "b": 151.66,
    "c": 47.92,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [0.81260],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [76.70,1.90],
    "number_observations_unique": 32175,
    "quality_factors": [
      {
        "type": "Redundancy",
        "value": 2.71
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.95,1.90],
      "quality_factors": [

      ]
    }
  ]

}
  

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


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