Data quality metrics extracted from 9dk1.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": "b033c31c7d04adee80cac1902cea6e03",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 57.704,
    "b": 90.280,
    "c": 148.953,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.95400],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [48.62,2.4],
    "number_observations_unique": 31270,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.434
      },
      {
        "type": "R(meas)",
        "value": 0.450
      },
      {
        "type": "R(pim)",
        "value": 0.118
      },
      {
        "type": "I/SigI",
        "value": 8.6
      },
      {
        "type": "Completeness",
        "value": 100
      },
      {
        "type": "Redundancy",
        "value": 27.3
      },
      {
        "type": "CC(1/2)",
        "value": 0.996
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.49,2.40],
      "number_observations_unique": 3235,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.794
        },
        {
          "type": "R(meas)",
          "value": 3.152
        },
        {
          "type": "R(pim)",
          "value": 1.433
        },
        {
          "type": "Redundancy",
          "value": 4.6
        },
        {
          "type": "CC(1/2)",
          "value": 0.369
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell
Low resolution limit [Å] 48.620 2.490
High resolution limit [Å] 2.400 2.400
R(merge) 0.4340 2.7940
R(meas) 0.4500 3.1520
R(pim) 0.1180 1.4330
CC(1/2) 0.996 0.369
Completeness [%] 100.0 -
Multiplicity 27.3 4.6


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

Resolution [Å] R(merge) R(meas) R(pim) CC(1/2) Multiplicity
2.490-2.400 2.7940 3.1520 1.4330 0.369 4.6