Data quality metrics extracted from 4xfo.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": "882fa9a975fdd2eb8e84874673d6f49e",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 4.75,
    "b": 10.66,
    "c": 16.39,
    "alpha": 77.64,
    "beta": 87.81,
    "gamma": 77.61
  },
  "wavelengths": [0.97920],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [16.01,1.35],
    "number_observations_unique": 629,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 6.93
      },
      {
        "type": "Completeness",
        "value": 92.6
      },
      {
        "type": "Redundancy",
        "value": 21.8
      }
    ]
  }
}
  

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


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