Data quality metrics extracted from 6s7z.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": "1cb84c96396057299291d316cec9721b",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 175.465,
    "b": 97.132,
    "c": 124.780,
    "alpha": 90.00,
    "beta": 102.74,
    "gamma": 90.00
  },
  "wavelengths": [0.97950],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [52.2000,1.850],
    "number_observations_unique": 173226,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.185
      },
      {
        "type": "R(meas)",
        "value": 0.206
      },
      {
        "type": "R(pim)",
        "value": 0.088
      },
      {
        "type": "I/SigI",
        "value": 6.800
      },
      {
        "type": "Completeness",
        "value": 99.400
      },
      {
        "type": "Redundancy",
        "value": 5.300
      },
      {
        "type": "CC(1/2)",
        "value": 0.991
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.950,1.850],
      "number_observations": 105262,
      "number_observations_unique": 24459,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.187
        },
        {
          "type": "R(meas)",
          "value": 1.349
        },
        {
          "type": "R(pim)",
          "value": 0.622
        },
        {
          "type": "I/SigI",
          "value": 1.200
        },
        {
          "type": "Completeness",
          "value": 96.300
        },
        {
          "type": "Redundancy",
          "value": 4.300
        },
        {
          "type": "CC(1/2)",
          "value": 0.477
        }
      ]
    },
    {
      "resolution_limits": [52.140,5.850],
      "number_observations": 30422,
      "number_observations_unique": 5656,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.069
        },
        {
          "type": "R(meas)",
          "value": 0.077
        },
        {
          "type": "R(pim)",
          "value": 0.033
        },
        {
          "type": "I/SigI",
          "value": 18.800
        },
        {
          "type": "Completeness",
          "value": 99.700
        },
        {
          "type": "Redundancy",
          "value": 5.400
        },
        {
          "type": "CC(1/2)",
          "value": 0.995
        }
      ]
    }
  ]

}

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

  Overall InnerShell OuterShell
Low resolution limit [Å] 52.200 52.140 52.140
High resolution limit [Å] 1.850 5.850 5.850
R(merge) 0.1850 0.0690 0.0690
R(meas) 0.2060 0.0770 0.0770
R(pim) 0.0880 0.0330 0.0330
CC(1/2) 0.991 0.995 0.995
Completeness [%] 99.4 99.7 99.7
Multiplicity 5.3 5.4 5.4

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

Resolution [Å] R(merge) R(meas) R(pim) CC(1/2) Completeness [%] Multiplicity
52.140-5.850 0.0690 0.0770 0.0330 0.995 99.7 5.4
1.950-1.850 1.1870 1.3490 0.6220 0.477 96.3 4.3