Data quality metrics extracted from 9bhy.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": "fd97fc693f9757f2e710f52185543f6c",
  "space_group_name": "P 1",
  "unit_cell": {
    "a": 56.410,
    "b": 74.478,
    "c": 75.493,
    "alpha": 85.04,
    "beta": 69.89,
    "gamma": 70.29
  },
  "wavelengths": [1.03373],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [35.62,2.30],
    "number_observations_unique": 47445,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.128
      },
      {
        "type": "R(meas)",
        "value": 0.1523
      },
      {
        "type": "R(pim)",
        "value": 0.08125
      },
      {
        "type": "I/SigI",
        "value": 10.32
      },
      {
        "type": "Completeness",
        "value": 98.25
      },
      {
        "type": "Redundancy",
        "value": 3.5
      },
      {
        "type": "CC(1/2)",
        "value": 0.99
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.382,2.30],
      "number_observations_unique": 4701,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.9187
        },
        {
          "type": "R(meas)",
          "value": 1.0
        },
        {
          "type": "R(pim)",
          "value": 0.5656
        },
        {
          "type": "I/SigI",
          "value": 1.42
        },
        {
          "type": "Completeness",
          "value": 97.14
        },
        {
          "type": "CC(1/2)",
          "value": 0.44
        }
      ]
    }
  ]

}
  

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


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