Data quality metrics extracted from 4k4a.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": "0e1e3a86fb2795a46b6e2ad1b55e8c48",
  "space_group_name": "P 21 21 2",
  "unit_cell": {
    "a": 97.689,
    "b": 117.943,
    "c": 48.193,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.54180],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [44.61,1.89],
    "number_observations_unique": 42793,
    "quality_factors": [

    ]
  }
}
  

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


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