Data quality metrics extracted from 4gdp.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": "63716f2abfc3fd0fdbbfbf8781dd13d9",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 78.851,
    "b": 81.885,
    "c": 104.791,
    "alpha": 78.07,
    "beta": 79.51,
    "gamma": 78.92
  },
  "wavelengths": [0.97920],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [100.0,1.9998],
    "number_observations_unique": 149689,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.109
      },
      {
        "type": "I/SigI",
        "value": 10.5
      },
      {
        "type": "Completeness",
        "value": 89.0
      },
      {
        "type": "Redundancy",
        "value": 3.4
      }
    ]
  }
}
  

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


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