Data quality metrics extracted from 4f8t.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": "4bb47ef593148df05210e67526d2bd01",
  "space_group_name": "P 21 2 21",
  "unit_cell": {
    "a": 39.841,
    "b": 78.430,
    "c": 98.412,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [0.97857],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50.00,2.38],
    "number_observations_unique": 12256,
    "quality_factors": [
      {
        "type": "Completeness",
        "value": 94.7
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [2.42,2.38],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 66.9
        }
      ]
    },
    {
      "resolution_limits": [2.47,2.42],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 75.3
        }
      ]
    },
    {
      "resolution_limits": [2.51,2.47],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 83.9
        }
      ]
    },
    {
      "resolution_limits": [2.56,2.51],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 88.0
        }
      ]
    },
    {
      "resolution_limits": [2.62,2.56],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 90.0
        }
      ]
    },
    {
      "resolution_limits": [2.68,2.62],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 93.2
        }
      ]
    },
    {
      "resolution_limits": [2.75,2.68],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 98.4
        }
      ]
    },
    {
      "resolution_limits": [2.82,2.75],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 97.5
        }
      ]
    },
    {
      "resolution_limits": [2.90,2.82],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 98.9
        }
      ]
    },
    {
      "resolution_limits": [3.00,2.90],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 100
        }
      ]
    },
    {
      "resolution_limits": [3.11,3.00],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 99.8
        }
      ]
    },
    {
      "resolution_limits": [3.23,3.11],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 100
        }
      ]
    },
    {
      "resolution_limits": [3.38,3.23],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 100
        }
      ]
    },
    {
      "resolution_limits": [3.55,3.38],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 100
        }
      ]
    },
    {
      "resolution_limits": [3.78,3.55],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 100
        }
      ]
    },
    {
      "resolution_limits": [4.07,3.78],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 100
        }
      ]
    },
    {
      "resolution_limits": [4.48,4.07],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 100
        }
      ]
    },
    {
      "resolution_limits": [5.13,4.48],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 99.8
        }
      ]
    },
    {
      "resolution_limits": [6.46,5.13],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 100.0
        }
      ]
    },
    {
      "resolution_limits": [50.00,6.46],
      "quality_factors": [
        {
          "type": "Completeness",
          "value": 99.3
        }
      ]
    }
  ]

}
  

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


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