Data quality metrics extracted from 7ene.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": "e51cde3cb5487a171c0fad391e6e54c5",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 62.755,
    "b": 112.952,
    "c": 92.355,
    "alpha": 90.000,
    "beta": 91.316,
    "gamma": 90.000
  },
  "wavelengths": [1.54100],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [29.18,2.98],
    "number_observations_unique": 25971,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.2769
      },
      {
        "type": "R(pim)",
        "value": 0.1235
      },
      {
        "type": "I/SigI",
        "value": 10.58
      },
      {
        "type": "Completeness",
        "value": 98.42
      },
      {
        "type": "Redundancy",
        "value": 4.8
      },
      {
        "type": "CC(1/2)",
        "value": 0.947
      }
    ]
  }
}
  

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


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