Data quality metrics extracted from 4w2f.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": "234ff30e7ee294acfaa81749c635a825",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
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    "b": 448.57,
    "c": 623.95,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97900],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
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    "quality_factors": [
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        "type": "R(merge)",
        "value": 0.193
      },
      {
        "type": "I/SigI",
        "value": 9.890
      },
      {
        "type": "Completeness",
        "value": 99.700
      },
      {
        "type": "Redundancy",
        "value": 8.346
      }
    ]
  },
  "refln_shells": [
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      "quality_factors": [
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          "value": 0.020
        },
        {
          "type": "R(meas)",
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        },
        {
          "type": "I/SigI",
          "value": 1.010
        },
        {
          "type": "Completeness",
          "value": 99.200
        }
      ]
    },
    {
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      "number_observations_unique": 161525,
      "quality_factors": [
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          "value": 0.020
        },
        {
          "type": "R(meas)",
          "value": 1.778
        },
        {
          "type": "I/SigI",
          "value": 1.240
        },
        {
          "type": "Completeness",
          "value": 99.400
        }
      ]
    },
    {
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      "number_observations_unique": 157433,
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        }
      ]
    },
    {
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      "quality_factors": [
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        },
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          "type": "I/SigI",
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        {
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          "value": 99.800
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      ]
    },
    {
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      "number_observations_unique": 148503,
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        {
          "type": "I/SigI",
          "value": 2.420
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        {
          "type": "Completeness",
          "value": 99.900
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      ]
    },
    {
      "resolution_limits": [2.870,2.770],
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      "number_observations_unique": 143400,
      "quality_factors": [
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          "value": 0.020
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        {
          "type": "R(meas)",
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        },
        {
          "type": "I/SigI",
          "value": 3.060
        },
        {
          "type": "Completeness",
          "value": 99.600
        }
      ]
    },
    {
      "resolution_limits": [2.980,2.870],
      "number_observations": 1221682,
      "number_observations_unique": 138767,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.020
        },
        {
          "type": "R(meas)",
          "value": 0.508
        },
        {
          "type": "I/SigI",
          "value": 4.430
        },
        {
          "type": "Completeness",
          "value": 99.900
        }
      ]
    },
    {
      "resolution_limits": [3.100,2.980],
      "number_observations": 1162722,
      "number_observations_unique": 133746,
      "quality_factors": [
        {
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          "value": 0.020
        },
        {
          "type": "R(meas)",
          "value": 0.361
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        {
          "type": "I/SigI",
          "value": 6.280
        },
        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [3.240,3.100],
      "number_observations": 1095596,
      "number_observations_unique": 128353,
      "quality_factors": [
        {
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          "value": 0.020
        },
        {
          "type": "R(meas)",
          "value": 0.266
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        {
          "type": "I/SigI",
          "value": 8.590
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        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
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      "number_observations_unique": 122646,
      "quality_factors": [
        {
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          "value": 0.020
        },
        {
          "type": "R(meas)",
          "value": 0.220
        },
        {
          "type": "I/SigI",
          "value": 10.500
        },
        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
      "resolution_limits": [3.580,3.390],
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      "number_observations_unique": 115956,
      "quality_factors": [
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        },
        {
          "type": "R(meas)",
          "value": 0.194
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        {
          "type": "I/SigI",
          "value": 12.090
        },
        {
          "type": "Completeness",
          "value": 99.400
        }
      ]
    },
    {
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      "quality_factors": [
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        {
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        {
          "type": "Completeness",
          "value": 99.900
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      ]
    },
    {
      "resolution_limits": [4.060,3.790],
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      "number_observations_unique": 103848,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.020
        },
        {
          "type": "R(meas)",
          "value": 0.144
        },
        {
          "type": "I/SigI",
          "value": 17.540
        },
        {
          "type": "Completeness",
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        }
      ]
    },
    {
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      "number_observations_unique": 96687,
      "quality_factors": [
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          "value": 0.020
        },
        {
          "type": "R(meas)",
          "value": 0.124
        },
        {
          "type": "I/SigI",
          "value": 19.710
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        {
          "type": "Completeness",
          "value": 99.800
        }
      ]
    },
    {
      "resolution_limits": [4.800,4.380],
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      "number_observations_unique": 88167,
      "quality_factors": [
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          "value": 0.020
        },
        {
          "type": "R(meas)",
          "value": 0.108
        },
        {
          "type": "I/SigI",
          "value": 21.760
        },
        {
          "type": "Completeness",
          "value": 98.800
        }
      ]
    },
    {
      "resolution_limits": [5.370,4.800],
      "number_observations": 673313,
      "number_observations_unique": 80711,
      "quality_factors": [
        {
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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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      "number_observations_unique": 71485,
      "quality_factors": [
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        {
          "type": "I/SigI",
          "value": 25.730
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        {
          "type": "Completeness",
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      "number_observations_unique": 59956,
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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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        {
          "type": "I/SigI",
          "value": 33.060
        },
        {
          "type": "Completeness",
          "value": 100.000
        }
      ]
    },
    {
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      "number_observations_unique": 26057,
      "quality_factors": [
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        },
        {
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          "value": 0.033
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        {
          "type": "I/SigI",
          "value": 38.910
        },
        {
          "type": "Completeness",
          "value": 97.900
        }
      ]
    }
  ]

}
  

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


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