Data quality metrics extracted from 3ihb.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": "97113f5e551ce3b5f1bce76c58f7752d",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 118.359,
    "b": 141.202,
    "c": 76.115,
    "alpha": 90.00,
    "beta": 105.37,
    "gamma": 90.00
  },
  "wavelengths": [0.97800],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [57.073,2.400],
    "number_observations_unique": 46819,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.13100
      },
      {
        "type": "I/SigI",
        "value": 4.3000
      },
      {
        "type": "Completeness",
        "value": 99.5
      },
      {
        "type": "Redundancy",
        "value": 3.100
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.53,2.40],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.41200
        },
        {
          "type": "I/SigI",
          "value": 1.700
        },
        {
          "type": "Completeness",
          "value": 98.6
        },
        {
          "type": "Redundancy",
          "value": 2.80
        }
      ]
    }
  ]

}
  

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


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