Data quality metrics extracted from 8rbd.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": "4c1e7aa4e60d4275f2049f2f2cf4f99e",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 41.230,
    "b": 74.136,
    "c": 96.774,
    "alpha": 90.00,
    "beta": 90.43,
    "gamma": 90.00
  },
  "wavelengths": [0.88560],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [20,1.50],
    "number_observations_unique": 92976,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.057
      },
      {
        "type": "R(meas)",
        "value": 0.064
      },
      {
        "type": "R(pim)",
        "value": 0.029
      },
      {
        "type": "I/SigI",
        "value": 12.55
      },
      {
        "type": "Completeness",
        "value": 99.72
      },
      {
        "type": "Redundancy",
        "value": 4.6
      },
      {
        "type": "CC(1/2)",
        "value": 0.999
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.61,1.55],
      "number_observations_unique": 8403,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.054
        },
        {
          "type": "R(meas)",
          "value": 1.188
        },
        {
          "type": "R(pim)",
          "value": 0.543
        },
        {
          "type": "I/SigI",
          "value": 1.01
        },
        {
          "type": "Completeness",
          "value": 98.91
        },
        {
          "type": "Redundancy",
          "value": 4.6
        },
        {
          "type": "CC(1/2)",
          "value": 0.585
        }
      ]
    }
  ]

}
  

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


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