Data quality metrics extracted from 7d29.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": "f06b654b7723c312c8c64089d3c4a35a",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 43.447,
    "b": 55.670,
    "c": 58.496,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.54000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [29.56,1.70],
    "number_observations_unique": 14744,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.022
      },
      {
        "type": "R(meas)",
        "value": 0.027
      },
      {
        "type": "I/SigI",
        "value": 33.3
      },
      {
        "type": "Completeness",
        "value": 91.2
      },
      {
        "type": "Redundancy",
        "value": 3.15
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.76,1.70],
      "number_observations_unique": 969,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.066
        },
        {
          "type": "R(meas)",
          "value": 0.081
        },
        {
          "type": "I/SigI",
          "value": 13.2
        },
        {
          "type": "Completeness",
          "value": 61.0
        },
        {
          "type": "Redundancy",
          "value": 2.84
        }
      ]
    }
  ]

}
  

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


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