Data quality metrics extracted from 1ok1.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": "955cf8dc96fb7058f4e0f7b94d3ab128",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 47.034,
    "b": 55.133,
    "c": 62.001,
    "alpha": 86.85,
    "beta": 84.92,
    "gamma": 65.03
  },
  "wavelengths": [1.74400],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [62.000,2.600],
    "number_observations_unique": 16177,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.09000
      },
      {
        "type": "I/SigI",
        "value": 5.6000
      },
      {
        "type": "Completeness",
        "value": 93.5
      },
      {
        "type": "Redundancy",
        "value": 7.600
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.74,2.60],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.17400
        },
        {
          "type": "I/SigI",
          "value": 3.900
        },
        {
          "type": "Completeness",
          "value": 90.0
        },
        {
          "type": "Redundancy",
          "value": 7.00
        }
      ]
    }
  ]

}
  

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


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