Data quality metrics extracted from 7h67.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": "0e61573cd2b1a6d81bd5f3e0f79de7b0",
  "space_group_name": "P 43",
  "unit_cell": {
    "a": 73.80,
    "b": 73.80,
    "c": 48.85,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.99985],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [73.72,1.35],
    "number_observations": 241878,
    "number_observations_unique": 56943,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.047
      },
      {
        "type": "R(meas)",
        "value": 0.054
      },
      {
        "type": "I/SigI",
        "value": 21.14
      },
      {
        "type": "Completeness",
        "value": 98.5
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.43,1.35],
      "number_observations": 17362,
      "number_observations_unique": 8357,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.282
        },
        {
          "type": "R(meas)",
          "value": 0.363
        },
        {
          "type": "I/SigI",
          "value": 5.65
        }
      ]
    },
    {
      "resolution_limits": [1.53,1.43],
      "number_observations": 30495,
      "number_observations_unique": 8860,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.214
        },
        {
          "type": "R(meas)",
          "value": 0.253
        },
        {
          "type": "I/SigI",
          "value": 9.72
        }
      ]
    },
    {
      "resolution_limits": [1.65,1.53],
      "number_observations": 38768,
      "number_observations_unique": 8013,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.152
        },
        {
          "type": "R(meas)",
          "value": 0.17
        },
        {
          "type": "I/SigI",
          "value": 15.69
        }
      ]
    },
    {
      "resolution_limits": [1.8,1.65],
      "number_observations": 35848,
      "number_observations_unique": 7278,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.098
        },
        {
          "type": "R(meas)",
          "value": 0.11
        },
        {
          "type": "I/SigI",
          "value": 20.96
        }
      ]
    },
    {
      "resolution_limits": [2.02,1.80],
      "number_observations": 35224,
      "number_observations_unique": 7090,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.061
        },
        {
          "type": "R(meas)",
          "value": 0.068
        },
        {
          "type": "I/SigI",
          "value": 27.27
        }
      ]
    },
    {
      "resolution_limits": [2.33,2.02],
      "number_observations": 30078,
      "number_observations_unique": 6025,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.042
        },
        {
          "type": "R(meas)",
          "value": 0.047
        },
        {
          "type": "I/SigI",
          "value": 33.30
        }
      ]
    },
    {
      "resolution_limits": [2.84,2.33],
      "number_observations": 25217,
      "number_observations_unique": 5068,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.044
        },
        {
          "type": "R(meas)",
          "value": 0.049
        },
        {
          "type": "I/SigI",
          "value": 32.16
        }
      ]
    },
    {
      "resolution_limits": [4.0,2.84],
      "number_observations": 19549,
      "number_observations_unique": 4028,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.034
        },
        {
          "type": "R(meas)",
          "value": 0.039
        },
        {
          "type": "I/SigI",
          "value": 36.14
        }
      ]
    },
    {
      "resolution_limits": [73.72,4.00],
      "number_observations": 9337,
      "number_observations_unique": 2224,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.024
        },
        {
          "type": "R(meas)",
          "value": 0.028
        },
        {
          "type": "I/SigI",
          "value": 40.23
        }
      ]
    }
  ]

}
  

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


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