Data quality metrics extracted from 9it4.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": "0e7ec98433042862ac02cb02886b1d3a",
  "space_group_name": "P 2 21 21",
  "unit_cell": {
    "a": 39.130,
    "b": 70.384,
    "c": 110.466,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97918],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [36.88,2.29],
    "number_observations_unique": 14058,
    "quality_factors": [
      {
        "type": "R(meas)",
        "value": 0.169
      },
      {
        "type": "R(pim)",
        "value": 0.053
      },
      {
        "type": "I/SigI",
        "value": 15.56
      },
      {
        "type": "Completeness",
        "value": 97.9
      },
      {
        "type": "Redundancy",
        "value": 10.0
      },
      {
        "type": "CC(1/2)",
        "value": 0.925
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.34,2.29],
      "number_observations_unique": 565,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.955
        }
      ]
    },
    {
      "resolution_limits": [2.38,2.34],
      "number_observations_unique": 617,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.954
        }
      ]
    },
    {
      "resolution_limits": [2.43,2.38],
      "number_observations_unique": 644,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.965
        }
      ]
    },
    {
      "resolution_limits": [2.48,2.43],
      "number_observations_unique": 682,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.979
        }
      ]
    },
    {
      "resolution_limits": [2.53,2.48],
      "number_observations_unique": 697,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.974
        }
      ]
    },
    {
      "resolution_limits": [2.59,2.53],
      "number_observations_unique": 704,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.976
        }
      ]
    },
    {
      "resolution_limits": [2.66,2.59],
      "number_observations_unique": 695,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.980
        }
      ]
    },
    {
      "resolution_limits": [2.73,2.66],
      "number_observations_unique": 704,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.985
        }
      ]
    },
    {
      "resolution_limits": [2.81,2.73],
      "number_observations_unique": 719,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.990
        }
      ]
    },
    {
      "resolution_limits": [2.90,2.81],
      "number_observations_unique": 695,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.991
        }
      ]
    },
    {
      "resolution_limits": [3.00,2.90],
      "number_observations_unique": 720,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.991
        }
      ]
    },
    {
      "resolution_limits": [3.12,3.00],
      "number_observations_unique": 707,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.992
        }
      ]
    },
    {
      "resolution_limits": [3.26,3.12],
      "number_observations_unique": 731,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.995
        }
      ]
    },
    {
      "resolution_limits": [3.44,3.26],
      "number_observations_unique": 690,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.995
        }
      ]
    },
    {
      "resolution_limits": [3.65,3.44],
      "number_observations_unique": 732,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.993
        }
      ]
    },
    {
      "resolution_limits": [3.93,3.65],
      "number_observations_unique": 732,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.991
        }
      ]
    },
    {
      "resolution_limits": [4.33,3.93],
      "number_observations_unique": 712,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.996
        }
      ]
    },
    {
      "resolution_limits": [4.95,4.33],
      "number_observations_unique": 742,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.994
        }
      ]
    },
    {
      "resolution_limits": [6.24,4.95],
      "number_observations_unique": 756,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.994
        }
      ]
    },
    {
      "resolution_limits": [36.88,6.24],
      "number_observations_unique": 814,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.994
        }
      ]
    }
  ]

}
  

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


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