Data quality metrics extracted from 8rp3.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": "94c8728952f0fb6221b208684c5f664a",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 181.106,
    "b": 79.153,
    "c": 59.103,
    "alpha": 90.000,
    "beta": 91.656,
    "gamma": 90.000
  },
  "wavelengths": [0.97620],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [90.52,2.45],
    "number_observations_unique": 30851,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.368
      },
      {
        "type": "R(meas)",
        "value": 0.434
      },
      {
        "type": "R(pim)",
        "value": 0.228
      },
      {
        "type": "I/SigI",
        "value": 4.9
      },
      {
        "type": "Completeness",
        "value": 100.0
      },
      {
        "type": "Redundancy",
        "value": 6.9
      },
      {
        "type": "CC(1/2)",
        "value": 0.982
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [90.52,8.83],
      "number_observations_unique": 697,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.055
        },
        {
          "type": "R(meas)",
          "value": 0.064
        },
        {
          "type": "R(pim)",
          "value": 0.033
        },
        {
          "type": "Redundancy",
          "value": 6.8
        },
        {
          "type": "CC(1/2)",
          "value": 0.997
        }
      ]
    },
    {
      "resolution_limits": [2.55,2.45],
      "number_observations_unique": 3454,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 3.093
        },
        {
          "type": "R(meas)",
          "value": 3.731
        },
        {
          "type": "R(pim)",
          "value": 2.066
        },
        {
          "type": "Redundancy",
          "value": 6.1
        },
        {
          "type": "CC(1/2)",
          "value": 0.278
        }
      ]
    }
  ]

}
  

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


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