Data quality metrics extracted from 9n7y.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": "a88f976ff95c70000c321cb2ca3a53a2",
  "space_group_name": "P 43 21 2",
  "unit_cell": {
    "a": 157.446,
    "b": 157.446,
    "c": 87.846,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.95370],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [47.02,3.08],
    "number_observations": 167335,
    "number_observations_unique": 21019,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.380
      },
      {
        "type": "R(meas)",
        "value": 0.407
      },
      {
        "type": "R(pim)",
        "value": 0.142
      },
      {
        "type": "I/SigI",
        "value": 5.4
      },
      {
        "type": "Completeness",
        "value": 100.0
      },
      {
        "type": "Redundancy",
        "value": 8.0
      },
      {
        "type": "CC(1/2)",
        "value": 0.985
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.29,3.08],
      "number_observations": 28219,
      "number_observations_unique": 3740,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.095
        },
        {
          "type": "R(meas)",
          "value": 2.250
        },
        {
          "type": "R(pim)",
          "value": 0.807
        },
        {
          "type": "I/SigI",
          "value": 1.1
        },
        {
          "type": "Redundancy",
          "value": 7.5
        },
        {
          "type": "CC(1/2)",
          "value": 0.307
        }
      ]
    }
  ]

}
  

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


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