Data quality metrics extracted from 9d15.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": "b20564028fac2df090ea7d1ff51c078b",
  "space_group_name": "P 43 2 2",
  "unit_cell": {
    "a": 60.293,
    "b": 60.293,
    "c": 158.323,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.03320],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [60.29,2.25],
    "number_observations_unique": 26448,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.2127
      },
      {
        "type": "R(meas)",
        "value": 0.2223
      },
      {
        "type": "R(pim)",
        "value": 0.0637
      },
      {
        "type": "I/SigI",
        "value": 11.74
      },
      {
        "type": "Completeness",
        "value": 99.9
      },
      {
        "type": "Redundancy",
        "value": 12.1
      },
      {
        "type": "CC(1/2)",
        "value": 0.986
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.33,2.25],
      "number_observations_unique": 1412,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 3.211
        },
        {
          "type": "R(meas)",
          "value": 3.349
        },
        {
          "type": "R(pim)",
          "value": 0.9443
        },
        {
          "type": "I/SigI",
          "value": 1.67
        },
        {
          "type": "Completeness",
          "value": 99.86
        },
        {
          "type": "Redundancy",
          "value": 12.5
        },
        {
          "type": "CC(1/2)",
          "value": 0.643
        }
      ]
    }
  ]

}
  

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


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