Data quality metrics extracted from 1tfu.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": "27a774b0222a094865ab3320d3cd2799",
  "space_group_name": "H 3 2",
  "unit_cell": {
    "a": 98.623,
    "b": 98.623,
    "c": 114.811,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [20,1.99],
    "number_observations_unique": 14805,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 44.9
      },
      {
        "type": "Redundancy",
        "value": 28.2
      }
    ]
  }
}
  

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


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