Data quality metrics extracted from 8us3.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": "bfc76b1980082e1a81bfcdba243e0c88",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 140.40,
    "b": 63.88,
    "c": 81.36,
    "alpha": 90.0,
    "beta": 99.4,
    "gamma": 90.0
  },
  "wavelengths": [0.97910],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [48.6,3.1],
    "number_observations_unique": 13130,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.04
      },
      {
        "type": "I/SigI",
        "value": 11.2
      },
      {
        "type": "Completeness",
        "value": 100
      },
      {
        "type": "Redundancy",
        "value": 2
      },
      {
        "type": "CC(1/2)",
        "value": 0.9
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.9,3.1],
      "number_observations_unique": 6674,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.8
        }
      ]
    },
    {
      "resolution_limits": [4.9,3.9],
      "number_observations_unique": 3324,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9
        }
      ]
    },
    {
      "resolution_limits": [5.9,4.9],
      "number_observations_unique": 1638,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.99
        }
      ]
    },
    {
      "resolution_limits": [6.9,5.9],
      "number_observations_unique": 822,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.99
        }
      ]
    },
    {
      "resolution_limits": [48.6,6.9],
      "number_observations_unique": 805,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.99
        }
      ]
    }
  ]

}
  

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


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