Data quality metrics extracted from 4nh1.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": "e93e7baefa490c3f3aa28615d75cb8d7",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 210.537,
    "b": 57.441,
    "c": 139.394,
    "alpha": 90.00,
    "beta": 118.54,
    "gamma": 90.00
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [46.24,3.3],
    "number_observations_unique": 21878,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.05
      },
      {
        "type": "I/SigI",
        "value": 13.85
      },
      {
        "type": "Redundancy",
        "value": 2.4
      }
    ]
  }
}
  

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


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