Data quality metrics extracted from 7i17.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": "2aa45684c80613160fb15df27e0328aa",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 67.89,
    "b": 99.84,
    "c": 103.65,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.91840],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [46.00,1.69],
    "number_observations": 453287,
    "number_observations_unique": 78664,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.125
      },
      {
        "type": "R(meas)",
        "value": 0.13699999999999998
      },
      {
        "type": "I/SigI",
        "value": 8.51
      },
      {
        "type": "Completeness",
        "value": 99.0
      },
      {
        "type": "CC(1/2)",
        "value": 0.997
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.79,1.69],
      "number_observations": 75913,
      "number_observations_unique": 12627,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.6469999999999998
        },
        {
          "type": "R(meas)",
          "value": 1.805
        },
        {
          "type": "I/SigI",
          "value": 0.87
        },
        {
          "type": "CC(1/2)",
          "value": 0.33
        }
      ]
    },
    {
      "resolution_limits": [1.92,1.79],
      "number_observations": 69653,
      "number_observations_unique": 11852,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.958
        },
        {
          "type": "R(meas)",
          "value": 1.052
        },
        {
          "type": "I/SigI",
          "value": 1.53
        },
        {
          "type": "CC(1/2)",
          "value": 0.609
        }
      ]
    },
    {
      "resolution_limits": [2.07,1.92],
      "number_observations": 64376,
      "number_observations_unique": 10922,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.545
        },
        {
          "type": "R(meas)",
          "value": 0.598
        },
        {
          "type": "I/SigI",
          "value": 2.84
        },
        {
          "type": "CC(1/2)",
          "value": 0.826
        }
      ]
    },
    {
      "resolution_limits": [2.27,2.07],
      "number_observations": 62462,
      "number_observations_unique": 10273,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.33899999999999997
        },
        {
          "type": "R(meas)",
          "value": 0.371
        },
        {
          "type": "I/SigI",
          "value": 4.97
        },
        {
          "type": "CC(1/2)",
          "value": 0.9259999999999999
        }
      ]
    },
    {
      "resolution_limits": [2.53,2.27],
      "number_observations": 52188,
      "number_observations_unique": 9194,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.218
        },
        {
          "type": "R(meas)",
          "value": 0.24
        },
        {
          "type": "I/SigI",
          "value": 7.70
        },
        {
          "type": "CC(1/2)",
          "value": 0.971
        }
      ]
    },
    {
      "resolution_limits": [2.92,2.53],
      "number_observations": 48537,
      "number_observations_unique": 8212,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.142
        },
        {
          "type": "R(meas)",
          "value": 0.156
        },
        {
          "type": "I/SigI",
          "value": 12.34
        },
        {
          "type": "CC(1/2)",
          "value": 0.9890000000000001
        }
      ]
    },
    {
      "resolution_limits": [3.58,2.92],
      "number_observations": 36897,
      "number_observations_unique": 6981,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.08
        },
        {
          "type": "R(meas)",
          "value": 0.08900000000000001
        },
        {
          "type": "I/SigI",
          "value": 19.60
        },
        {
          "type": "CC(1/2)",
          "value": 0.9940000000000001
        }
      ]
    },
    {
      "resolution_limits": [5.04,3.58],
      "number_observations": 27247,
      "number_observations_unique": 5419,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.053
        },
        {
          "type": "R(meas)",
          "value": 0.059000000000000004
        },
        {
          "type": "I/SigI",
          "value": 28.14
        },
        {
          "type": "CC(1/2)",
          "value": 0.997
        }
      ]
    },
    {
      "resolution_limits": [46.00,5.04],
      "number_observations": 16014,
      "number_observations_unique": 3184,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.043
        },
        {
          "type": "R(meas)",
          "value": 0.048
        },
        {
          "type": "I/SigI",
          "value": 30.36
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    }
  ]

}
  

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


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