Data quality metrics extracted from 7g8i.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": "59eb49c81b98fb781a9a0818559d49b8",
  "space_group_name": "P 43 21 2",
  "unit_cell": {
    "a": 70.966,
    "b": 70.966,
    "c": 195.747,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.92124],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [66.720,2.470],
    "number_observations": 485098,
    "number_observations_unique": 18885,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.586
      },
      {
        "type": "R(meas)",
        "value": 0.598
      },
      {
        "type": "R(pim)",
        "value": 0.116
      },
      {
        "type": "I/SigI",
        "value": 6.100
      },
      {
        "type": "Completeness",
        "value": 100.000
      },
      {
        "type": "Redundancy",
        "value": 25.700
      },
      {
        "type": "CC(1/2)",
        "value": 0.994
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.600,2.470],
      "number_observations": 67437,
      "number_observations_unique": 2678,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 6.190
        },
        {
          "type": "R(meas)",
          "value": 6.316
        },
        {
          "type": "R(pim)",
          "value": 1.249
        },
        {
          "type": "I/SigI",
          "value": 0.800
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 25.200
        },
        {
          "type": "CC(1/2)",
          "value": 0.496
        }
      ]
    },
    {
      "resolution_limits": [66.720,7.810],
      "number_observations": 14359,
      "number_observations_unique": 720,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.097
        },
        {
          "type": "R(meas)",
          "value": 0.099
        },
        {
          "type": "R(pim)",
          "value": 0.021
        },
        {
          "type": "I/SigI",
          "value": 19.600
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 19.900
        },
        {
          "type": "CC(1/2)",
          "value": 0.999
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell
Low resolution limit [Å] 66.720 66.720
High resolution limit [Å] 2.470 7.810
R(merge) 0.5860 0.0970
R(meas) 0.5980 0.0990
R(pim) 0.1160 0.0210
CC(1/2) 0.994 0.999
Completeness [%] 100.0 100.0
Multiplicity 25.7 19.9


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

Resolution [Å] R(merge) R(meas) R(pim) CC(1/2) Completeness [%] Multiplicity
66.720-7.810 0.0970 0.0990 0.0210 0.999 100.0 19.9
2.600-2.470 6.1900 6.3160 1.2490 0.496 100.0 25.2