Data quality metrics extracted from 7lri.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": "42567096fb8e4ad83f6865e1d76b23f2",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 89.423,
    "b": 131.073,
    "c": 129.847,
    "alpha": 90.000,
    "beta": 101.549,
    "gamma": 90.000
  },
  "wavelengths": [0.97700],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50.0,3.05],
    "number_observations_unique": 55508,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.121
      },
      {
        "type": "R(meas)",
        "value": 0.127
      },
      {
        "type": "R(pim)",
        "value": 0.052
      },
      {
        "type": "I/SigI",
        "value": 14.22
      },
      {
        "type": "Completeness",
        "value": 99.10
      },
      {
        "type": "Redundancy",
        "value": 6.6
      },
      {
        "type": "CC(1/2)",
        "value": 0.912
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.10,3.05],
      "number_observations_unique": 2697,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.01
        },
        {
          "type": "R(meas)",
          "value": 0.01
        },
        {
          "type": "R(pim)",
          "value": 0.464
        },
        {
          "type": "I/SigI",
          "value": 1.44
        },
        {
          "type": "Completeness",
          "value": 96.5
        },
        {
          "type": "Redundancy",
          "value": 5.3
        },
        {
          "type": "CC(1/2)",
          "value": 0.597
        }
      ]
    }
  ]

}
  

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

  Overall InnerShell
Low resolution limit [Å] 50.000 3.100
High resolution limit [Å] 3.050 3.050
R(merge) 0.1210 0.0100
R(meas) 0.1270 0.0100
R(pim) 0.0520 0.4640
CC(1/2) 0.912 0.597
Completeness [%] 99.1 96.5
Multiplicity 6.6 5.3


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

Resolution [Å] R(merge) R(meas) R(pim) CC(1/2) Completeness [%] Multiplicity
3.100-3.050 0.0100 0.0100 0.4640 0.597 96.5 5.3