Data quality metrics extracted from 9d4x.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": "1a250b93b8d89a7ad5f70274b145d7c8",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 63.306,
    "b": 80.946,
    "c": 65.883,
    "alpha": 90.00,
    "beta": 106.61,
    "gamma": 90.00
  },
  "wavelengths": [0.97926],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [60.738,1.847],
    "number_observations_unique": 50948,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 10.9
      },
      {
        "type": "Completeness",
        "value": 93.2
      },
      {
        "type": "Redundancy",
        "value": 5.30
      },
      {
        "type": "CC(1/2)",
        "value": 0.997
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.879,1.847],
      "number_observations_unique": 2730,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.603
        }
      ]
    }
  ]

}
  

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


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