Data quality metrics extracted from 1ivw.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": "61b0e56cd9d5ae94816f51ad70d8f838",
  "space_group_name": "I 1 2 1",
  "unit_cell": {
    "a": 157.007,
    "b": 62.896,
    "c": 182.834,
    "alpha": 90.00,
    "beta": 111.82,
    "gamma": 90.00
  },
  "wavelengths": [0.70000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [25.27,1.80],
    "number_observations_unique": 149580,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.085
      },
      {
        "type": "Completeness",
        "value": 97.4
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.9,1.8],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.418
        },
        {
          "type": "Completeness",
          "value": 92.7
        }
      ]
    }
  ]

}
  

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


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