Data quality metrics extracted from 6dhf.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
  "mxlims_type": "ReflectionSet",
  "version": "0.2.2",
  "uuid": "83c5274560a6ad034164355a58a82477",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 116.817,
    "b": 220.888,
    "c": 307.020,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.30500],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [30.43,2.08],
    "number_observations_unique": 472399,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 14.999
      },
      {
        "type": "Completeness",
        "value": 99.96
      },
      {
        "type": "Redundancy",
        "value": 211.04
      },
      {
        "type": "CC(1/2)",
        "value": 0.975
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [30.43,5.646],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 120.472
        },
        {
          "type": "Completeness",
          "value": 99.21
        },
        {
          "type": "Redundancy",
          "value": 748.25
        },
        {
          "type": "CC(1/2)",
          "value": 0.975
        }
      ]
    },
    {
      "resolution_limits": [5.646,4.481],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 60.978
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 527.46
        },
        {
          "type": "CC(1/2)",
          "value": 0.978
        }
      ]
    },
    {
      "resolution_limits": [4.481,3.915],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 41.333
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 467.28
        },
        {
          "type": "CC(1/2)",
          "value": 0.972
        }
      ]
    },
    {
      "resolution_limits": [3.915,3.557],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 22.446
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 431.40
        },
        {
          "type": "CC(1/2)",
          "value": 0.954
        }
      ]
    },
    {
      "resolution_limits": [3.557,3.302],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 14.396
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 405.53
        },
        {
          "type": "CC(1/2)",
          "value": 0.929
        }
      ]
    },
    {
      "resolution_limits": [3.302,3.107],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 8.494
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 372.93
        },
        {
          "type": "CC(1/2)",
          "value": 0.879
        }
      ]
    },
    {
      "resolution_limits": [3.107,2.951],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 5.249
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 314.99
        },
        {
          "type": "CC(1/2)",
          "value": 0.794
        }
      ]
    },
    {
      "resolution_limits": [2.951,2.823],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 3.865
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 211.47
        },
        {
          "type": "CC(1/2)",
          "value": 0.698
        }
      ]
    },
    {
      "resolution_limits": [2.823,2.714],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 2.959
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 148.63
        },
        {
          "type": "CC(1/2)",
          "value": 0.574
        }
      ]
    },
    {
      "resolution_limits": [2.714,2.621],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 2.389
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 111.97
        },
        {
          "type": "CC(1/2)",
          "value": 0.436
        }
      ]
    },
    {
      "resolution_limits": [2.621,2.539],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 2.001
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 88.66
        },
        {
          "type": "CC(1/2)",
          "value": 0.331
        }
      ]
    },
    {
      "resolution_limits": [2.539,2.466],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 1.823
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 74.67
        },
        {
          "type": "CC(1/2)",
          "value": 0.244
        }
      ]
    },
    {
      "resolution_limits": [2.466,2.401],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 1.470
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 60.04
        },
        {
          "type": "CC(1/2)",
          "value": 0.151
        }
      ]
    },
    {
      "resolution_limits": [2.401,2.343],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 1.384
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 50.58
        },
        {
          "type": "CC(1/2)",
          "value": 0.094
        }
      ]
    },
    {
      "resolution_limits": [2.343,2.289],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 1.218
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 42.99
        },
        {
          "type": "CC(1/2)",
          "value": 0.069
        }
      ]
    },
    {
      "resolution_limits": [2.289,2.241],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 1.112
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 36.85
        },
        {
          "type": "CC(1/2)",
          "value": 0.028
        }
      ]
    },
    {
      "resolution_limits": [2.241,2.196],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 0.987
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 30.88
        },
        {
          "type": "CC(1/2)",
          "value": 0.027
        }
      ]
    },
    {
      "resolution_limits": [2.196,2.154],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 0.847
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 24.59
        },
        {
          "type": "CC(1/2)",
          "value": 0.022
        }
      ]
    },
    {
      "resolution_limits": [2.154,2.116],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 0.661
        },
        {
          "type": "Completeness",
          "value": 100.00
        },
        {
          "type": "Redundancy",
          "value": 17.91
        },
        {
          "type": "CC(1/2)",
          "value": 0.012
        }
      ]
    },
    {
      "resolution_limits": [2.116,2.080],
      "quality_factors": [
        {
          "type": "I/SigI",
          "value": 0.533
        },
        {
          "type": "Completeness",
          "value": 99.95
        },
        {
          "type": "Redundancy",
          "value": 12.11
        },
        {
          "type": "CC(1/2)",
          "value": 0.013
        }
      ]
    }
  ]

}
  

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


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