Data quality metrics extracted from 7dbs.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": "1e3b8b05103dc7ab9b48673d2970a45d",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 115.918,
    "b": 44.700,
    "c": 54.472,
    "alpha": 90.000,
    "beta": 104.072,
    "gamma": 90.000
  },
  "wavelengths": [0.97951],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [52.84,2.33],
    "number_observations_unique": 11509,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.062
      },
      {
        "type": "R(pim)",
        "value": 0.027
      },
      {
        "type": "I/SigI",
        "value": 13.2
      },
      {
        "type": "Completeness",
        "value": 98.1
      },
      {
        "type": "Redundancy",
        "value": 6.6
      },
      {
        "type": "CC(1/2)",
        "value": 0.996
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.372,2.332],
      "number_observations_unique": 567,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.631
        },
        {
          "type": "R(pim)",
          "value": 0.258
        },
        {
          "type": "I/SigI",
          "value": 2.4
        },
        {
          "type": "Completeness",
          "value": 100.0
        },
        {
          "type": "CC(1/2)",
          "value": 0.949
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell
Low resolution limit [Å] 52.840 2.372
High resolution limit [Å] 2.330 2.332
R(merge) 0.0620 0.6310
R(pim) 0.0270 0.2580
CC(1/2) 0.996 0.949
Completeness [%] 98.1 100.0
Multiplicity 6.6 -


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

Resolution [Å] R(merge) R(pim) CC(1/2) Completeness [%]
2.372-2.332 0.6310 0.2580 0.949 100.0