Data quality metrics extracted from 5ihw.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": "89f6d099e33173554a42f5b39136e7e6",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 39.26,
    "b": 41.56,
    "c": 51.14,
    "alpha": 95.59,
    "beta": 97.55,
    "gamma": 99.55
  },
  "wavelengths": [0.97820],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50.32,1.25],
    "number_observations_unique": 75580,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.056
      },
      {
        "type": "I/SigI",
        "value": 8.10
      },
      {
        "type": "Completeness",
        "value": 87.0
      },
      {
        "type": "Redundancy",
        "value": 3.7
      }
    ]
  }
}
  

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


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