Data quality metrics extracted from 4it7.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": "8e80c0709282cdd9b5e6b07901c8d98a",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 43.510,
    "b": 44.499,
    "c": 44.582,
    "alpha": 90.00,
    "beta": 89.99,
    "gamma": 90.00
  },
  "wavelengths": [0.97920,1.54056],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [44.58,2.1],
    "number_observations_unique": 19288,
    "quality_factors": [
      {
        "type": "Completeness",
        "value": 98.8
      }
    ]
  }
}
  

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


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