Data quality metrics extracted from 4tpl.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
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  "version": "0.2.2",
  "uuid": "9f7bf164deb7b59fd4176dc10da10f79",
  "space_group_name": "P 3 2 1",
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    "b": 167.85,
    "c": 93.73,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [1.74625],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
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    "number_observations_unique": 33918,
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        "value": 0.313
      },
      {
        "type": "R(meas)",
        "value": 0.315
      },
      {
        "type": "I/SigI",
        "value": 19.640
      },
      {
        "type": "Completeness",
        "value": 100.000
      },
      {
        "type": "Redundancy",
        "value": 96
      }
    ]
  },
  "refln_shells": [
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      "quality_factors": [
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          "value": 9.000
        },
        {
          "type": "R(meas)",
          "value": 9.091
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        {
          "type": "I/SigI",
          "value": 0.690
        },
        {
          "type": "Completeness",
          "value": 99.900
        },
        {
          "type": "Redundancy",
          "value": 50
        }
      ]
    },
    {
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      "number_observations_unique": 2989,
      "quality_factors": [
        {
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          "value": 6.339
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        {
          "type": "R(meas)",
          "value": 6.381
        },
        {
          "type": "I/SigI",
          "value": 1.230
        },
        {
          "type": "Completeness",
          "value": 100.000
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      ]
    },
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        {
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      ]
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    {
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      "quality_factors": [
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          "type": "R(meas)",
          "value": 3.992
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        {
          "type": "I/SigI",
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          "type": "Completeness",
          "value": 100.000
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      ]
    },
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      "number_observations_unique": 3353,
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          "value": 2.949
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        {
          "type": "R(meas)",
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        {
          "type": "I/SigI",
          "value": 3.090
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        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [3.270,3.200],
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      "number_observations_unique": 3060,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 2.220
        },
        {
          "type": "R(meas)",
          "value": 2.231
        },
        {
          "type": "I/SigI",
          "value": 4.230
        },
        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [3.350,3.270],
      "number_observations": 320065,
      "number_observations_unique": 3198,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.827
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        {
          "type": "R(meas)",
          "value": 1.836
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        {
          "type": "I/SigI",
          "value": 5.160
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        {
          "type": "Completeness",
          "value": 100.000
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      ]
    },
    {
      "resolution_limits": [3.440,3.350],
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      "number_observations_unique": 3271,
      "quality_factors": [
        {
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          "value": 1.372
        },
        {
          "type": "R(meas)",
          "value": 1.379
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        {
          "type": "I/SigI",
          "value": 6.870
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        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
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      "number_observations_unique": 3523,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 1.084
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        {
          "type": "R(meas)",
          "value": 1.089
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        {
          "type": "I/SigI",
          "value": 8.760
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        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [3.660,3.550],
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      "quality_factors": [
        {
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          "value": 0.876
        },
        {
          "type": "R(meas)",
          "value": 0.880
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        {
          "type": "I/SigI",
          "value": 10.690
        },
        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
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      "number_observations_unique": 3242,
      "quality_factors": [
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          "type": "R(merge)",
          "value": 0.651
        },
        {
          "type": "R(meas)",
          "value": 0.654
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        {
          "type": "I/SigI",
          "value": 14.070
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        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
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      "quality_factors": [
        {
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        {
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        {
          "type": "I/SigI",
          "value": 16.850
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        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [4.120,3.940],
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      "number_observations_unique": 3304,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.405
        },
        {
          "type": "R(meas)",
          "value": 0.407
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        {
          "type": "I/SigI",
          "value": 21.790
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        {
          "type": "Completeness",
          "value": 100.000
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      ]
    },
    {
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      "number_observations_unique": 3303,
      "quality_factors": [
        {
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          "value": 0.310
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        {
          "type": "R(meas)",
          "value": 0.312
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        {
          "type": "I/SigI",
          "value": 27.460
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        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [4.610,4.340],
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      "number_observations_unique": 3233,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.223
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        {
          "type": "R(meas)",
          "value": 0.224
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        {
          "type": "I/SigI",
          "value": 34.910
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        {
          "type": "Completeness",
          "value": 100.000
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      ]
    },
    {
      "resolution_limits": [4.970,4.610],
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      "number_observations_unique": 3292,
      "quality_factors": [
        {
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          "value": 0.198
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        {
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        {
          "type": "I/SigI",
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        {
          "type": "Completeness",
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      ]
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    {
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      "quality_factors": [
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        {
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          "value": 37.780
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      "quality_factors": [
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        {
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        {
          "type": "I/SigI",
          "value": 41.050
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        {
          "type": "Completeness",
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      ]
    },
    {
      "resolution_limits": [7.880,6.260],
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      "number_observations_unique": 3240,
      "quality_factors": [
        {
          "type": "R(merge)",
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        },
        {
          "type": "R(meas)",
          "value": 0.141
        },
        {
          "type": "I/SigI",
          "value": 50.840
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        {
          "type": "Completeness",
          "value": 100.000
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      ]
    },
    {
      "resolution_limits": [48.454,7.880],
      "number_observations": 319865,
      "number_observations_unique": 3270,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.094
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        {
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          "value": 0.095
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        {
          "type": "I/SigI",
          "value": 66.920
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        {
          "type": "Completeness",
          "value": 99.600
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      ]
    }
  ]

}
  

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


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