Data quality metrics extracted from 3red.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": "d9c9ecde813074ed052e7c2b8b7c4dfd",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 112.019,
    "b": 113.302,
    "c": 169.488,
    "alpha": 89.92,
    "beta": 79.13,
    "gamma": 80.83
  },
  "wavelengths": [0.90000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [100,3.0],
    "number_observations_unique": 143272,
    "quality_factors": [
      {
        "type": "Completeness",
        "value": 96.0
      }
    ]
  }
}
  

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


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