Data quality metrics extracted from 6t78.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": "6b9f8f0b3627cbde209d1f0a363bc381",
  "space_group_name": "P 61",
  "unit_cell": {
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    "b": 106.13,
    "c": 76.89,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 120.0
  },
  "wavelengths": [0.99900],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
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    "number_observations_unique": 17066,
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        "value": 0.126
      },
      {
        "type": "R(meas)",
        "value": 0.129
      },
      {
        "type": "I/SigI",
        "value": 16.540
      },
      {
        "type": "Completeness",
        "value": 99.900
      },
      {
        "type": "Redundancy",
        "value": 20.550
      },
      {
        "type": "CC(1/2)",
        "value": 1.000
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    ]
  },
  "refln_shells": [
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          "value": 2.786
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          "value": 2.858
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        {
          "type": "I/SigI",
          "value": 0.870
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        {
          "type": "Completeness",
          "value": 99.200
        },
        {
          "type": "Redundancy",
          "value": 19.973
        },
        {
          "type": "CC(1/2)",
          "value": 0.660
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      ]
    },
    {
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          "type": "R(merge)",
          "value": 2.325
        },
        {
          "type": "R(meas)",
          "value": 2.383
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        {
          "type": "I/SigI",
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        {
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        {
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        {
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        {
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          "value": 1.848
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        {
          "type": "I/SigI",
          "value": 1.680
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        {
          "type": "Completeness",
          "value": 99.800
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        {
          "type": "Redundancy",
          "value": 20.712
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          "value": 0.804
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          "value": 1.318
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        {
          "type": "R(meas)",
          "value": 1.353
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        {
          "type": "I/SigI",
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        {
          "type": "Completeness",
          "value": 100.000
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        {
          "type": "Redundancy",
          "value": 19.601
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        {
          "type": "CC(1/2)",
          "value": 0.905
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      ]
    },
    {
      "resolution_limits": [2.890,2.800],
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      "number_observations_unique": 1114,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.907
        },
        {
          "type": "R(meas)",
          "value": 0.929
        },
        {
          "type": "I/SigI",
          "value": 3.540
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        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 20.752
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        {
          "type": "CC(1/2)",
          "value": 0.945
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      ]
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    {
      "resolution_limits": [2.990,2.890],
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      "number_observations_unique": 1084,
      "quality_factors": [
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          "type": "R(merge)",
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        {
          "type": "R(meas)",
          "value": 0.728
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        {
          "type": "I/SigI",
          "value": 4.570
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        {
          "type": "Completeness",
          "value": 99.900
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        {
          "type": "Redundancy",
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        {
          "type": "CC(1/2)",
          "value": 0.975
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      ]
    },
    {
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      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.544
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        {
          "type": "R(meas)",
          "value": 0.557
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        {
          "type": "I/SigI",
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        {
          "type": "Completeness",
          "value": 100.000
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        {
          "type": "Redundancy",
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        {
          "type": "CC(1/2)",
          "value": 0.979
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      ]
    },
    {
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      "number_observations_unique": 1007,
      "quality_factors": [
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          "type": "R(merge)",
          "value": 0.373
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        {
          "type": "R(meas)",
          "value": 0.383
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        {
          "type": "I/SigI",
          "value": 9.270
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        {
          "type": "Completeness",
          "value": 100.000
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        {
          "type": "Redundancy",
          "value": 20.633
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        {
          "type": "CC(1/2)",
          "value": 0.988
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      ]
    },
    {
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      "quality_factors": [
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          "value": 0.271
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        {
          "type": "R(meas)",
          "value": 0.278
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        {
          "type": "I/SigI",
          "value": 12.340
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        {
          "type": "Completeness",
          "value": 100.000
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        {
          "type": "Redundancy",
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        {
          "type": "CC(1/2)",
          "value": 0.994
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      ]
    },
    {
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      "number_observations_unique": 939,
      "quality_factors": [
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          "value": 0.207
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        {
          "type": "R(meas)",
          "value": 0.213
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        {
          "type": "I/SigI",
          "value": 15.530
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        {
          "type": "Completeness",
          "value": 100.000
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        {
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          "value": 19.569
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        {
          "type": "CC(1/2)",
          "value": 0.996
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      ]
    },
    {
      "resolution_limits": [3.730,3.540],
      "number_observations": 18525,
      "number_observations_unique": 868,
      "quality_factors": [
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          "type": "R(merge)",
          "value": 0.144
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        {
          "type": "R(meas)",
          "value": 0.148
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        {
          "type": "I/SigI",
          "value": 22.160
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        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 21.342
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        {
          "type": "CC(1/2)",
          "value": 0.998
        }
      ]
    },
    {
      "resolution_limits": [3.960,3.730],
      "number_observations": 17847,
      "number_observations_unique": 844,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.113
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        {
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          "value": 0.116
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        {
          "type": "I/SigI",
          "value": 26.230
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        {
          "type": "Completeness",
          "value": 100.000
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        {
          "type": "Redundancy",
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        {
          "type": "CC(1/2)",
          "value": 0.999
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    },
    {
      "resolution_limits": [4.230,3.960],
      "number_observations": 16437,
      "number_observations_unique": 785,
      "quality_factors": [
        {
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          "value": 0.096
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        {
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        {
          "type": "I/SigI",
          "value": 31.220
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        {
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        {
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          "type": "CC(1/2)",
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      ]
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    {
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      "quality_factors": [
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        {
          "type": "I/SigI",
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        {
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        {
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        {
          "type": "CC(1/2)",
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    {
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      "number_observations_unique": 685,
      "quality_factors": [
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          "type": "R(merge)",
          "value": 0.074
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        {
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        {
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        {
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          "value": 0.076
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        {
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        {
          "type": "I/SigI",
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        {
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    {
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      "quality_factors": [
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        {
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        {
          "type": "I/SigI",
          "value": 39.810
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        {
          "type": "Completeness",
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        {
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    {
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      "quality_factors": [
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          "value": 0.052
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        {
          "type": "R(meas)",
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        {
          "type": "I/SigI",
          "value": 51.710
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        {
          "type": "Completeness",
          "value": 100.000
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        {
          "type": "Redundancy",
          "value": 20.066
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        {
          "type": "CC(1/2)",
          "value": 0.999
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    },
    {
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          "type": "R(merge)",
          "value": 0.040
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        {
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        {
          "type": "I/SigI",
          "value": 64.210
        },
        {
          "type": "Completeness",
          "value": 100.000
        },
        {
          "type": "Redundancy",
          "value": 20.325
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        {
          "type": "CC(1/2)",
          "value": 1.000
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      ]
    },
    {
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      "quality_factors": [
        {
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          "value": 0.036
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        {
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        {
          "type": "I/SigI",
          "value": 70.020
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        {
          "type": "Completeness",
          "value": 98.600
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        {
          "type": "Redundancy",
          "value": 18.388
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        {
          "type": "CC(1/2)",
          "value": 1.000
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      ]
    }
  ]

}
  

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


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