Data quality metrics extracted from 34wn.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
  "mxlims_type": "ReflectionSet",
  "version": "0.2.3",
  "uuid": "d4a954661c6c1f39eeec80691398ebfb",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 69.024,
    "b": 46.378,
    "c": 93.414,
    "alpha": 90.000,
    "beta": 102.409,
    "gamma": 90.000
  },
  "wavelengths": [0.93928],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [38.202,1.55],
    "number_observations_unique": 84158,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.1706
      },
      {
        "type": "R(pim)",
        "value": 0.048
      },
      {
        "type": "I/SigI",
        "value": 8.9
      },
      {
        "type": "Completeness",
        "value": 99.879
      },
      {
        "type": "Redundancy",
        "value": 13.603
      },
      {
        "type": "CC(1/2)",
        "value": 0.9973
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [38.214,3.338],
      "number_observations_unique": 8644,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.0775
        },
        {
          "type": "R(pim)",
          "value": 0.048
        },
        {
          "type": "I/SigI",
          "value": 32.848
        },
        {
          "type": "Completeness",
          "value": 99.884
        },
        {
          "type": "Redundancy",
          "value": 13.633
        },
        {
          "type": "CC(1/2)",
          "value": 0.9973
        }
      ]
    },
    {
      "resolution_limits": [1.58,1.55],
      "number_observations_unique": 4167,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.545
        },
        {
          "type": "R(pim)",
          "value": 0.442
        },
        {
          "type": "I/SigI",
          "value": 0.9
        },
        {
          "type": "Completeness",
          "value": 99.98
        },
        {
          "type": "Redundancy",
          "value": 13.0
        },
        {
          "type": "CC(1/2)",
          "value": 0.648
        }
      ]
    }
  ]

}
  

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


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