Data quality metrics extracted from 9ud7.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
  "mxlims_type": "ReflectionSet",
  "version": "0.2.3",
  "uuid": "093b71f7348f57ef9685c9ef39e35259",
  "space_group_name": "P 21 21 2",
  "unit_cell": {
    "a": 159.43,
    "b": 181.57,
    "c": 89.74,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97946],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [71.824,2.49],
    "number_observations_unique": 91785,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.275
      },
      {
        "type": "R(meas)",
        "value": 0.286
      },
      {
        "type": "I/SigI",
        "value": 9.6
      },
      {
        "type": "Completeness",
        "value": 99.94
      },
      {
        "type": "Redundancy",
        "value": 13.1
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [71.85,6.76],
      "number_observations_unique": 4885,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    },
    {
      "resolution_limits": [6.76,5.36],
      "number_observations_unique": 4699,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.996
        }
      ]
    },
    {
      "resolution_limits": [5.36,4.69],
      "number_observations_unique": 4659,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.997
        }
      ]
    },
    {
      "resolution_limits": [4.69,4.26],
      "number_observations_unique": 4636,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.997
        }
      ]
    },
    {
      "resolution_limits": [4.26,3.95],
      "number_observations_unique": 4621,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.996
        }
      ]
    },
    {
      "resolution_limits": [3.95,3.72],
      "number_observations_unique": 4592,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.993
        }
      ]
    },
    {
      "resolution_limits": [3.72,3.53],
      "number_observations_unique": 4604,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.99
        }
      ]
    },
    {
      "resolution_limits": [3.53,3.38],
      "number_observations_unique": 4560,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.984
        }
      ]
    },
    {
      "resolution_limits": [3.38,3.25],
      "number_observations_unique": 4575,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.979
        }
      ]
    },
    {
      "resolution_limits": [3.25,3.14],
      "number_observations_unique": 4576,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.968
        }
      ]
    },
    {
      "resolution_limits": [3.14,3.04],
      "number_observations_unique": 4542,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.951
        }
      ]
    },
    {
      "resolution_limits": [3.04,2.95],
      "number_observations_unique": 4542,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.928
        }
      ]
    },
    {
      "resolution_limits": [2.95,2.87],
      "number_observations_unique": 4572,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.897
        }
      ]
    },
    {
      "resolution_limits": [2.87,2.8],
      "number_observations_unique": 4507,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.883
        }
      ]
    },
    {
      "resolution_limits": [2.8,2.74],
      "number_observations_unique": 4558,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.83
        }
      ]
    },
    {
      "resolution_limits": [2.74,2.68],
      "number_observations_unique": 4570,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.778
        }
      ]
    },
    {
      "resolution_limits": [2.68,2.63],
      "number_observations_unique": 4512,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.734
        }
      ]
    },
    {
      "resolution_limits": [2.63,2.58],
      "number_observations_unique": 4540,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.681
        }
      ]
    },
    {
      "resolution_limits": [2.58,2.53],
      "number_observations_unique": 4528,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.631
        }
      ]
    },
    {
      "resolution_limits": [2.53,2.49],
      "number_observations_unique": 4534,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.604
        }
      ]
    }
  ]

}
  

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


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