Data quality metrics extracted from 3aa5.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": "528a26a0dbf9464415da8aa1987bcc3f",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 42.563,
    "b": 85.582,
    "c": 36.277,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [42.79,2.10],
    "number_observations_unique": 8637,
    "quality_factors": [

    ]
  }
}
  

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


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