Data quality metrics extracted from 3ib1.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": "845db1a18c703fe36459a8e1702f12af",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 63.839,
    "b": 50.654,
    "c": 66.119,
    "alpha": 90.00,
    "beta": 107.56,
    "gamma": 90.00
  },
  "wavelengths": [1.54000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [62.990,2.200],
    "number_observations_unique": 17853,
    "quality_factors": [
      {
        "type": "Completeness",
        "value": 91.0
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.30,2.20],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 93.0
        }
      ]
    }
  ]

}
  

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


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