Data quality metrics extracted from 9t7o.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": "e337837ff2e1b18429becf2e9d00e29c",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 87.58,
    "b": 73.25,
    "c": 103.42,
    "alpha": 90.00,
    "beta": 101.32,
    "gamma": 90.00
  },
  "wavelengths": [1.05960],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [46.41,1.34],
    "number_observations_unique": 272034,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.179
      },
      {
        "type": "R(meas)",
        "value": 0.193
      },
      {
        "type": "I/SigI",
        "value": 6.90
      },
      {
        "type": "Completeness",
        "value": 94.7
      },
      {
        "type": "Redundancy",
        "value": 7.14
      },
      {
        "type": "CC(1/2)",
        "value": 0.998
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.37,1.34],
      "number_observations_unique": 19597,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.143
        },
        {
          "type": "R(meas)",
          "value": 2.308
        },
        {
          "type": "CC(1/2)",
          "value": 0.169
        }
      ]
    },
    {
      "resolution_limits": [1.41,1.37],
      "number_observations_unique": 19198,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.085
        },
        {
          "type": "R(meas)",
          "value": 2.25
        },
        {
          "type": "CC(1/2)",
          "value": 0.205
        }
      ]
    },
    {
      "resolution_limits": [1.45,1.41],
      "number_observations_unique": 18580,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.793
        },
        {
          "type": "R(meas)",
          "value": 1.943
        },
        {
          "type": "CC(1/2)",
          "value": 0.267
        }
      ]
    },
    {
      "resolution_limits": [1.5,1.45],
      "number_observations_unique": 17830,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.697
        },
        {
          "type": "R(meas)",
          "value": 1.835
        },
        {
          "type": "CC(1/2)",
          "value": 0.398
        }
      ]
    },
    {
      "resolution_limits": [1.55,1.50],
      "number_observations_unique": 17786,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.685
        },
        {
          "type": "R(meas)",
          "value": 1.811
        },
        {
          "type": "CC(1/2)",
          "value": 0.545
        }
      ]
    },
    {
      "resolution_limits": [1.6,1.55],
      "number_observations_unique": 17304,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.576
        },
        {
          "type": "R(meas)",
          "value": 1.694
        },
        {
          "type": "CC(1/2)",
          "value": 0.681
        }
      ]
    },
    {
      "resolution_limits": [1.66,1.60],
      "number_observations_unique": 16753,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.261
        },
        {
          "type": "R(meas)",
          "value": 1.357
        },
        {
          "type": "CC(1/2)",
          "value": 0.78
        }
      ]
    },
    {
      "resolution_limits": [1.73,1.66],
      "number_observations_unique": 16169,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.935
        },
        {
          "type": "R(meas)",
          "value": 1.007
        },
        {
          "type": "CC(1/2)",
          "value": 0.848
        }
      ]
    },
    {
      "resolution_limits": [1.81,1.73],
      "number_observations_unique": 15528,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.695
        },
        {
          "type": "R(meas)",
          "value": 0.75
        },
        {
          "type": "CC(1/2)",
          "value": 0.897
        }
      ]
    },
    {
      "resolution_limits": [1.9,1.81],
      "number_observations_unique": 14893,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.469
        },
        {
          "type": "R(meas)",
          "value": 0.507
        },
        {
          "type": "CC(1/2)",
          "value": 0.936
        }
      ]
    },
    {
      "resolution_limits": [2.0,1.90],
      "number_observations_unique": 13608,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.308
        },
        {
          "type": "R(meas)",
          "value": 0.335
        },
        {
          "type": "CC(1/2)",
          "value": 0.954
        }
      ]
    },
    {
      "resolution_limits": [2.12,2.00],
      "number_observations_unique": 13644,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.241
        },
        {
          "type": "R(meas)",
          "value": 0.259
        },
        {
          "type": "CC(1/2)",
          "value": 0.983
        }
      ]
    },
    {
      "resolution_limits": [2.27,2.12],
      "number_observations_unique": 12809,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.183
        },
        {
          "type": "R(meas)",
          "value": 0.197
        },
        {
          "type": "CC(1/2)",
          "value": 0.989
        }
      ]
    },
    {
      "resolution_limits": [2.45,2.27],
      "number_observations_unique": 12001,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.147
        },
        {
          "type": "R(meas)",
          "value": 0.158
        },
        {
          "type": "CC(1/2)",
          "value": 0.992
        }
      ]
    },
    {
      "resolution_limits": [2.68,2.45],
      "number_observations_unique": 11050,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.124
        },
        {
          "type": "R(meas)",
          "value": 0.134
        },
        {
          "type": "CC(1/2)",
          "value": 0.994
        }
      ]
    },
    {
      "resolution_limits": [3.0,2.68],
      "number_observations_unique": 10011,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.095
        },
        {
          "type": "R(meas)",
          "value": 0.102
        },
        {
          "type": "CC(1/2)",
          "value": 0.995
        }
      ]
    },
    {
      "resolution_limits": [3.46,3.00],
      "number_observations_unique": 8775,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.068
        },
        {
          "type": "R(meas)",
          "value": 0.074
        },
        {
          "type": "CC(1/2)",
          "value": 0.996
        }
      ]
    },
    {
      "resolution_limits": [4.24,3.46],
      "number_observations_unique": 7266,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.054
        },
        {
          "type": "R(meas)",
          "value": 0.058
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    },
    {
      "resolution_limits": [5.99,4.24],
      "number_observations_unique": 5932,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.051
        },
        {
          "type": "R(meas)",
          "value": 0.055
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    },
    {
      "resolution_limits": [46.41,5.99],
      "number_observations_unique": 3300,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.05
        },
        {
          "type": "R(meas)",
          "value": 0.054
        },
        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    }
  ]

}
  

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


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