Data quality metrics extracted from 3kpb.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": "2e5f327e3b7aff4c4c8a37910320df76",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 46.987,
    "b": 49.704,
    "c": 59.120,
    "alpha": 80.11,
    "beta": 75.85,
    "gamma": 64.04
  },
  "wavelengths": [0.87260],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [57.170,1.600],
    "number_observations_unique": 55517,
    "quality_factors": [
      {
        "type": "Redundancy",
        "value": 3.200
      }
    ]
  }
}
  

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


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