Data quality metrics extracted from 7qsi.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": "e9c4952dfc9867b7aa0056b5dbff31fc",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 42.36,
    "b": 41.56,
    "c": 72.07,
    "alpha": 90.000,
    "beta": 104.495,
    "gamma": 90.000
  },
  "wavelengths": [0.99990],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [41.2,1.30],
    "number_observations_unique": 52866,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.064
      },
      {
        "type": "R(meas)",
        "value": 0.07
      },
      {
        "type": "I/SigI",
        "value": 19.54
      },
      {
        "type": "Completeness",
        "value": 88.9
      },
      {
        "type": "Redundancy",
        "value": 6.11
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.34,1.30],
      "number_observations_unique": 2056,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.732
        },
        {
          "type": "R(meas)",
          "value": 0.844
        },
        {
          "type": "I/SigI",
          "value": 2.1
        },
        {
          "type": "Completeness",
          "value": 46.7
        },
        {
          "type": "Redundancy",
          "value": 3.98
        },
        {
          "type": "CC(1/2)",
          "value": 0.638
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell
Low resolution limit [Å] 41.200 1.340
High resolution limit [Å] 1.300 1.300
R(merge) 0.0640 0.7320
R(meas) 0.0700 0.8440
CC(1/2) 0.999 0.638
Completeness [%] 88.9 46.7
Multiplicity 6.1 4.0


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

Resolution [Å] R(merge) R(meas) CC(1/2) Completeness [%] Multiplicity
1.340-1.300 0.7320 0.8440 0.638 46.7 4.0