Data quality metrics extracted from 9vmq.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
  "mxlims_type": "ReflectionSet",
  "version": "0.2.3",
  "uuid": "1e16700383699f93dbb2b7318d078597",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 50.888,
    "b": 54.596,
    "c": 82.942,
    "alpha": 91.40,
    "beta": 91.11,
    "gamma": 91.93
  },
  "wavelengths": [0.97918],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50.89,1.79],
    "number_observations_unique": 81024,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 5.5
      },
      {
        "type": "Completeness",
        "value": 95.9
      },
      {
        "type": "Redundancy",
        "value": 2.9
      },
      {
        "type": "CC(1/2)",
        "value": 0.995
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.88,1.79],
      "number_observations_unique": 11747,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.923
        }
      ]
    }
  ]

}
  

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


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