Data quality metrics extracted from 7aom.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": "c1bf96b9ecc64dbee7e06aff5331de02",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 46.243,
    "b": 49.532,
    "c": 135.032,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [46.5,1.95],
    "number_observations_unique": 23223,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.1735
      },
      {
        "type": "R(meas)",
        "value": 0.1812
      },
      {
        "type": "I/SigI",
        "value": 7.66
      },
      {
        "type": "Completeness",
        "value": 99.49
      },
      {
        "type": "Redundancy",
        "value": 12.8
      },
      {
        "type": "CC(1/2)",
        "value": 0.972
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.022,1.95],
      "number_observations_unique": 2217,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.7252
        },
        {
          "type": "R(meas)",
          "value": 0.7554
        },
        {
          "type": "I/SigI",
          "value": 0.75
        },
        {
          "type": "Completeness",
          "value": 96.89
        },
        {
          "type": "Redundancy",
          "value": 13.6
        },
        {
          "type": "CC(1/2)",
          "value": 0.873
        }
      ]
    }
  ]

}
  

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


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