Data quality metrics extracted from 3d5h.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": "ab4f2aa81480ad663c7ffe614e812b1f",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 42.803,
    "b": 65.400,
    "c": 49.435,
    "alpha": 90.0,
    "beta": 102.0,
    "gamma": 90.0
  },
  "wavelengths": [1.54132],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [48.224,2.0],
    "number_observations_unique": 16787,
    "quality_factors": [
      {
        "type": "Completeness",
        "value": 97.5
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.05,2.0],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 97.6
        }
      ]
    }
  ]

}
  

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


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