Data quality metrics extracted from 3uob.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": "7df0b1d07815a5599f4dab2f7325782e",
  "space_group_name": "P 65",
  "unit_cell": {
    "a": 163.418,
    "b": 163.418,
    "c": 54.701,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [0.97918],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50,3.0],
    "number_observations_unique": 11703,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.096
      },
      {
        "type": "I/SigI",
        "value": 13.0
      },
      {
        "type": "Completeness",
        "value": 59.3
      },
      {
        "type": "Redundancy",
        "value": 4.7
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [3.05,3.00],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 0.53
        },
        {
          "type": "Completeness",
          "value": 59.3
        },
        {
          "type": "Redundancy",
          "value": 4.1
        }
      ]
    },
    {
      "resolution_limits": [3.11,3.05],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 63.3
        }
      ]
    },
    {
      "resolution_limits": [3.17,3.11],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 65.2
        }
      ]
    },
    {
      "resolution_limits": [3.23,3.17],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 69.8
        }
      ]
    },
    {
      "resolution_limits": [3.28,3.23],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 74.1
        }
      ]
    },
    {
      "resolution_limits": [3.33,3.28],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 75.9
        }
      ]
    }
  ]

}
  

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


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