Data quality metrics extracted from 3t1o.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": "121b536f1721be07e7f17293ccb4b8a2",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 45.30,
    "b": 47.85,
    "c": 53.08,
    "alpha": 108.37,
    "beta": 100.10,
    "gamma": 92.92
  },
  "wavelengths": [0.97874],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [45.1,1.9],
    "number_observations_unique": 34257,
    "quality_factors": [
      {
        "type": "Completeness",
        "value": 96.2
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.95,1.9],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 95.8
        }
      ]
    }
  ]

}
  

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


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