Data quality metrics extracted from 9oml.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": "db857bd2b084de3a050c51bdcbd50925",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 43.15,
    "b": 122.35,
    "c": 45.59,
    "alpha": 90.000,
    "beta": 93.516,
    "gamma": 90.000
  },
  "wavelengths": [0.95370],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [45.50,1.61],
    "number_observations_unique": 60682,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 4.9
      },
      {
        "type": "Completeness",
        "value": 99.6
      },
      {
        "type": "Redundancy",
        "value": 6.9
      },
      {
        "type": "CC(1/2)",
        "value": 0.994
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.968,1.9],
      "number_observations_unique": 3674,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.442
        }
      ]
    }
  ]

}
  

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


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