Data quality metrics extracted from 2qe8.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": "620b956a965053a4be40080a442a1134",
  "space_group_name": "P 21 21 2",
  "unit_cell": {
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    "b": 135.562,
    "c": 51.519,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.98091,0.97929,0.89194,0.97905],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
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    "number_observations_unique": 170743,
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        "value": 0.052
      },
      {
        "type": "I/SigI",
        "value": 8.200
      },
      {
        "type": "Completeness",
        "value": 95.900
      },
      {
        "type": "Redundancy",
        "value": 4.800
      }
    ]
  },
  "refln_shells": [
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      "number_observations_unique": 9561,
      "quality_factors": [
        {
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        {
          "type": "I/SigI",
          "value": 1.1
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        },
        {
          "type": "Redundancy",
          "value": 2.10
        }
      ]
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      "quality_factors": [
        {
          "type": "R(merge)",
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        },
        {
          "type": "I/SigI",
          "value": 2.6
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          "type": "Completeness",
          "value": 82.90
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        {
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          "value": 2.30
        }
      ]
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        {
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        {
          "type": "I/SigI",
          "value": 2.6
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        {
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          "value": 97.30
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        {
          "type": "Redundancy",
          "value": 3.40
        }
      ]
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      "quality_factors": [
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        {
          "type": "I/SigI",
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          "type": "Completeness",
          "value": 100.00
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        {
          "type": "Redundancy",
          "value": 4.00
        }
      ]
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      "resolution_limits": [1.61,1.56],
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      "number_observations_unique": 11283,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.144
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        {
          "type": "I/SigI",
          "value": 4.7
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 4.00
        }
      ]
    },
    {
      "resolution_limits": [1.68,1.61],
      "number_observations": 44071,
      "number_observations_unique": 10896,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.118
        },
        {
          "type": "I/SigI",
          "value": 6.0
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 4.00
        }
      ]
    },
    {
      "resolution_limits": [1.74,1.68],
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      "number_observations_unique": 10493,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.098
        },
        {
          "type": "I/SigI",
          "value": 6.8
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        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 4.00
        }
      ]
    },
    {
      "resolution_limits": [1.82,1.74],
      "number_observations": 41058,
      "number_observations_unique": 10096,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.079
        },
        {
          "type": "I/SigI",
          "value": 8.5
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 4.10
        }
      ]
    },
    {
      "resolution_limits": [1.91,1.82],
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      "number_observations_unique": 9673,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.089
        },
        {
          "type": "I/SigI",
          "value": 6.9
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 4.70
        }
      ]
    },
    {
      "resolution_limits": [2.01,1.91],
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      "number_observations_unique": 9190,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.088
        },
        {
          "type": "I/SigI",
          "value": 3.9
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        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 5.20
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      ]
    },
    {
      "resolution_limits": [2.14,2.01],
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      "number_observations_unique": 8696,
      "quality_factors": [
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          "type": "R(merge)",
          "value": 0.076
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        {
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          "value": 8.1
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        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 5.80
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      ]
    },
    {
      "resolution_limits": [2.28,2.14],
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      "number_observations_unique": 8212,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.070
        },
        {
          "type": "I/SigI",
          "value": 9.0
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 6.80
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      ]
    },
    {
      "resolution_limits": [2.47,2.28],
      "number_observations": 59252,
      "number_observations_unique": 7706,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.063
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        {
          "type": "I/SigI",
          "value": 9.6
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        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 7.70
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      ]
    },
    {
      "resolution_limits": [2.70,2.47],
      "number_observations": 54309,
      "number_observations_unique": 7056,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.058
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        {
          "type": "I/SigI",
          "value": 10.5
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 7.70
        }
      ]
    },
    {
      "resolution_limits": [3.02,2.70],
      "number_observations": 49310,
      "number_observations_unique": 6409,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.050
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        {
          "type": "I/SigI",
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          "type": "Completeness",
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        {
          "type": "Redundancy",
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      ]
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    {
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      "number_observations_unique": 5655,
      "quality_factors": [
        {
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          "value": 0.044
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        {
          "type": "I/SigI",
          "value": 13.4
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          "type": "Completeness",
          "value": 99.60
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          "value": 7.70
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      "resolution_limits": [4.27,3.49],
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      "number_observations_unique": 4819,
      "quality_factors": [
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          "value": 15.3
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          "type": "Completeness",
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        {
          "type": "Redundancy",
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      ]
    },
    {
      "resolution_limits": [6.04,4.27],
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      "number_observations_unique": 3758,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.035
        },
        {
          "type": "I/SigI",
          "value": 16.3
        },
        {
          "type": "Completeness",
          "value": 98.70
        },
        {
          "type": "Redundancy",
          "value": 7.40
        }
      ]
    },
    {
      "resolution_limits": [29.348,6.04],
      "number_observations": 14463,
      "number_observations_unique": 2126,
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.035
        },
        {
          "type": "I/SigI",
          "value": 15.8
        },
        {
          "type": "Completeness",
          "value": 96.80
        },
        {
          "type": "Redundancy",
          "value": 6.80
        }
      ]
    }
  ]

}
  

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


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