Data quality metrics extracted from 7ii3.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": "7533744409616f61f32f8d9ce3f6b0f3",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 45.23,
    "b": 73.48,
    "c": 52.45,
    "alpha": 90.00,
    "beta": 109.12,
    "gamma": 90.00
  },
  "wavelengths": [0.91840],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [34.70,1.3],
    "number_observations": 267929,
    "number_observations_unique": 78657,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.102
      },
      {
        "type": "R(meas)",
        "value": 0.121
      },
      {
        "type": "I/SigI",
        "value": 7.14
      },
      {
        "type": "Completeness",
        "value": 98.2
      },
      {
        "type": "CC(1/2)",
        "value": 0.997
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.38,1.30],
      "number_observations": 41714,
      "number_observations_unique": 12489,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.476
        },
        {
          "type": "R(meas)",
          "value": 1.758
        },
        {
          "type": "I/SigI",
          "value": 0.73
        },
        {
          "type": "CC(1/2)",
          "value": 0.317
        }
      ]
    },
    {
      "resolution_limits": [1.47,1.38],
      "number_observations": 41190,
      "number_observations_unique": 11976,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.945
        },
        {
          "type": "R(meas)",
          "value": 1.12
        },
        {
          "type": "I/SigI",
          "value": 1.20
        },
        {
          "type": "CC(1/2)",
          "value": 0.549
        }
      ]
    },
    {
      "resolution_limits": [1.59,1.47],
      "number_observations": 36531,
      "number_observations_unique": 11099,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.585
        },
        {
          "type": "R(meas)",
          "value": 0.699
        },
        {
          "type": "I/SigI",
          "value": 1.93
        },
        {
          "type": "CC(1/2)",
          "value": 0.741
        }
      ]
    },
    {
      "resolution_limits": [1.74,1.59],
      "number_observations": 35516,
      "number_observations_unique": 10283,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.354
        },
        {
          "type": "R(meas)",
          "value": 0.42
        },
        {
          "type": "I/SigI",
          "value": 3.30
        },
        {
          "type": "CC(1/2)",
          "value": 0.889
        }
      ]
    },
    {
      "resolution_limits": [1.95,1.74],
      "number_observations": 32789,
      "number_observations_unique": 9300,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.189
        },
        {
          "type": "R(meas)",
          "value": 0.223
        },
        {
          "type": "I/SigI",
          "value": 6.24
        },
        {
          "type": "CC(1/2)",
          "value": 0.968
        }
      ]
    },
    {
      "resolution_limits": [2.25,1.95],
      "number_observations": 26435,
      "number_observations_unique": 8079,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.105
        },
        {
          "type": "R(meas)",
          "value": 0.126
        },
        {
          "type": "I/SigI",
          "value": 10.73
        },
        {
          "type": "CC(1/2)",
          "value": 0.987
        }
      ]
    },
    {
      "resolution_limits": [2.75,2.25],
      "number_observations": 24853,
      "number_observations_unique": 7011,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.071
        },
        {
          "type": "R(meas)",
          "value": 0.083
        },
        {
          "type": "I/SigI",
          "value": 15.89
        },
        {
          "type": "CC(1/2)",
          "value": 0.994
        }
      ]
    },
    {
      "resolution_limits": [3.88,2.75],
      "number_observations": 18624,
      "number_observations_unique": 5401,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.043
        },
        {
          "type": "R(meas)",
          "value": 0.051
        },
        {
          "type": "I/SigI",
          "value": 24.41
        },
        {
          "type": "CC(1/2)",
          "value": 0.997
        }
      ]
    }
  ]

}
  

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


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