Data quality metrics extracted from 1i12.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": "cb90bdb1d5595bb04324b631ef375373",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 156.559,
    "b": 51.842,
    "c": 92.232,
    "alpha": 90.00,
    "beta": 107.81,
    "gamma": 90.00
  },
  "wavelengths": [0.93260],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [26.82,1.30],
    "number_observations_unique": 547136,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.0450000
      },
      {
        "type": "I/SigI",
        "value": 7.9724
      },
      {
        "type": "Completeness",
        "value": 96.1
      },
      {
        "type": "Redundancy",
        "value": 2.05
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.35,1.3],
      "number_observations_unique": 15590,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.3760000
        },
        {
          "type": "I/SigI",
          "value": 1.9
        },
        {
          "type": "Completeness",
          "value": 92.3
        },
        {
          "type": "Redundancy",
          "value": 1.8
        }
      ]
    }
  ]

}
  

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


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