Data quality metrics extracted from 9i9n.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": "a0bde1adf63b9388562022a91e14b77a",
  "space_group_name": "P 41 21 2",
  "unit_cell": {
    "a": 46.458,
    "b": 46.458,
    "c": 143.776,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.87313],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [44.21,1.88],
    "number_observations_unique": 12610,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.03682
      },
      {
        "type": "I/SigI",
        "value": 15.50
      },
      {
        "type": "Completeness",
        "value": 92.84
      },
      {
        "type": "Redundancy",
        "value": 2.0
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.947,1.88],
      "number_observations_unique": 841,
      "quality_factors": [
        {
          "type": "R(meas)",
          "value": 0.3467
        },
        {
          "type": "I/SigI",
          "value": 2.07
        },
        {
          "type": "CC(1/2)",
          "value": 0.806
        }
      ]
    }
  ]

}
  

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


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