Data quality metrics extracted from 7l6w.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": "855a3f564cf15f3e971abef9c3fb6200",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 100.4,
    "b": 31.5,
    "c": 54.5,
    "alpha": 90.0,
    "beta": 107.4,
    "gamma": 90.0
  },
  "wavelengths": [1.31400],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [30.94,2.300],
    "number_observations_unique": 7118,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 2.600
      },
      {
        "type": "Completeness",
        "value": 95.8
      },
      {
        "type": "Redundancy",
        "value": 1
      },
      {
        "type": "CC(1/2)",
        "value": 0.90
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.380,2.300],
      "number_observations_unique": 560,
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 1.1
        },
        {
          "type": "Completeness",
          "value": 78.100
        },
        {
          "type": "Redundancy",
          "value": 1.000
        },
        {
          "type": "CC(1/2)",
          "value": 0.36
        }
      ]
    }
  ]

}
  

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


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