Data quality metrics extracted from 1nkp.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": "e942d787bb1a8b337e6a9eace11239ad",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 39.244,
    "b": 45.128,
    "c": 86.484,
    "alpha": 87.91,
    "beta": 84.61,
    "gamma": 71.50
  },
  "wavelengths": [0.91000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [20.0,1.8],
    "number_observations_unique": 49228,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.053
      },
      {
        "type": "Completeness",
        "value": 95.9
      }
    ]
  }
}
  

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


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