Data quality metrics extracted from 6ndj.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": "eef10cfa59a65e772314c035c11f0ab1",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 38.283,
    "b": 65.364,
    "c": 102.362,
    "alpha": 95.63,
    "beta": 92.13,
    "gamma": 106.59
  },
  "wavelengths": [0.97910],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [101.63,2.27],
    "number_observations_unique": 43656,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 10.5
      },
      {
        "type": "Completeness",
        "value": 92.3
      },
      {
        "type": "Redundancy",
        "value": 7.3
      }
    ]
  }
}
  

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


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