Data quality metrics extracted from 7iaw.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": "03d88b280decb118a9cb04de10b4ad25",
  "space_group_name": "P 43 21 2",
  "unit_cell": {
    "a": 60.22,
    "b": 60.22,
    "c": 214.54,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.91840],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [46.06,1.45],
    "number_observations": 810622,
    "number_observations_unique": 71207,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.071
      },
      {
        "type": "R(meas)",
        "value": 0.075
      },
      {
        "type": "I/SigI",
        "value": 20.71
      },
      {
        "type": "Completeness",
        "value": 100.0
      },
      {
        "type": "CC(1/2)",
        "value": 1.0
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.54,1.45],
      "number_observations": 133797,
      "number_observations_unique": 11303,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.172
        },
        {
          "type": "R(meas)",
          "value": 1.225
        },
        {
          "type": "I/SigI",
          "value": 2.13
        },
        {
          "type": "CC(1/2)",
          "value": 0.789
        }
      ]
    },
    {
      "resolution_limits": [1.64,1.54],
      "number_observations": 123077,
      "number_observations_unique": 10646,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.737
        },
        {
          "type": "R(meas)",
          "value": 0.7709999999999999
        },
        {
          "type": "I/SigI",
          "value": 3.32
        },
        {
          "type": "CC(1/2)",
          "value": 0.8959999999999999
        }
      ]
    },
    {
      "resolution_limits": [1.78,1.64],
      "number_observations": 111496,
      "number_observations_unique": 9977,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.418
        },
        {
          "type": "R(meas)",
          "value": 0.43799999999999994
        },
        {
          "type": "I/SigI",
          "value": 5.56
        },
        {
          "type": "CC(1/2)",
          "value": 0.9590000000000001
        }
      ]
    },
    {
      "resolution_limits": [1.94,1.78],
      "number_observations": 108911,
      "number_observations_unique": 9175,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.22899999999999998
        },
        {
          "type": "R(meas)",
          "value": 0.24
        },
        {
          "type": "I/SigI",
          "value": 10.38
        },
        {
          "type": "CC(1/2)",
          "value": 0.9890000000000001
        }
      ]
    },
    {
      "resolution_limits": [2.17,1.94],
      "number_observations": 92666,
      "number_observations_unique": 8343,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.125
        },
        {
          "type": "R(meas)",
          "value": 0.131
        },
        {
          "type": "I/SigI",
          "value": 18.79
        },
        {
          "type": "CC(1/2)",
          "value": 0.996
        }
      ]
    },
    {
      "resolution_limits": [2.51,2.17],
      "number_observations": 88015,
      "number_observations_unique": 7445,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.084
        },
        {
          "type": "R(meas)",
          "value": 0.087
        },
        {
          "type": "I/SigI",
          "value": 30.13
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    },
    {
      "resolution_limits": [3.07,2.51],
      "number_observations": 69434,
      "number_observations_unique": 6326,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.053
        },
        {
          "type": "R(meas)",
          "value": 0.055
        },
        {
          "type": "I/SigI",
          "value": 44.68
        },
        {
          "type": "CC(1/2)",
          "value": 0.9990000000000001
        }
      ]
    },
    {
      "resolution_limits": [4.33,3.07],
      "number_observations": 53944,
      "number_observations_unique": 5026,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.03
        },
        {
          "type": "R(meas)",
          "value": 0.032
        },
        {
          "type": "I/SigI",
          "value": 72.09
        },
        {
          "type": "CC(1/2)",
          "value": 1.0
        }
      ]
    },
    {
      "resolution_limits": [46.06,4.33],
      "number_observations": 29282,
      "number_observations_unique": 2966,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.024
        },
        {
          "type": "R(meas)",
          "value": 0.025
        },
        {
          "type": "I/SigI",
          "value": 80.33
        },
        {
          "type": "CC(1/2)",
          "value": 1.0
        }
      ]
    }
  ]

}
  

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


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