Data quality metrics extracted from 9ulf.cif.gz by aB_cif2table1 from BUSTER (Global Phasing Ltd.). See also the PDBx/mmCIF dictionary.

Raw JSON data
{
  "mxlims_type": "ReflectionSet",
  "version": "0.2.3",
  "uuid": "0f8c280e74acf07959f3f3c3a8bc5207",
  "space_group_name": "C 1 2 1",
  "unit_cell": {
    "a": 75.106,
    "b": 70.496,
    "c": 76.471,
    "alpha": 90.00,
    "beta": 94.18,
    "gamma": 90.00
  },
  "wavelengths": [0.97918],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50.00,1.949],
    "number_observations_unique": 29005,
    "quality_factors": [
      {
        "type": "I/SigI",
        "value": 11.95
      },
      {
        "type": "Completeness",
        "value": 99.400
      },
      {
        "type": "Redundancy",
        "value": 6.58
      },
      {
        "type": "CC(1/2)",
        "value": 0.9863
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [50.00,8.55],
      "number_observations_unique": 350,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9816
        }
      ]
    },
    {
      "resolution_limits": [8.55,6.10],
      "number_observations_unique": 626,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9746
        }
      ]
    },
    {
      "resolution_limits": [6.10,5.00],
      "number_observations_unique": 760,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9762
        }
      ]
    },
    {
      "resolution_limits": [5.00,4.34],
      "number_observations_unique": 918,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9808
        }
      ]
    },
    {
      "resolution_limits": [4.34,3.88],
      "number_observations_unique": 1030,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9839
        }
      ]
    },
    {
      "resolution_limits": [3.88,3.55],
      "number_observations_unique": 1145,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9736
        }
      ]
    },
    {
      "resolution_limits": [3.55,3.29],
      "number_observations_unique": 1235,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9723
        }
      ]
    },
    {
      "resolution_limits": [3.29,3.07],
      "number_observations_unique": 1320,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9669
        }
      ]
    },
    {
      "resolution_limits": [3.07,2.90],
      "number_observations_unique": 1404,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9719
        }
      ]
    },
    {
      "resolution_limits": [2.90,2.75],
      "number_observations_unique": 1492,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9723
        }
      ]
    },
    {
      "resolution_limits": [2.75,2.62],
      "number_observations_unique": 1549,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9606
        }
      ]
    },
    {
      "resolution_limits": [2.62,2.51],
      "number_observations_unique": 1646,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9593
        }
      ]
    },
    {
      "resolution_limits": [2.51,2.41],
      "number_observations_unique": 1680,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9333
        }
      ]
    },
    {
      "resolution_limits": [2.41,2.33],
      "number_observations_unique": 1769,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9185
        }
      ]
    },
    {
      "resolution_limits": [2.33,2.25],
      "number_observations_unique": 1833,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.9247
        }
      ]
    },
    {
      "resolution_limits": [2.25,2.18],
      "number_observations_unique": 1893,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.8504
        }
      ]
    },
    {
      "resolution_limits": [2.18,2.11],
      "number_observations_unique": 1944,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.8769
        }
      ]
    },
    {
      "resolution_limits": [2.11,2.05],
      "number_observations_unique": 1975,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.7694
        }
      ]
    },
    {
      "resolution_limits": [2.05,2.00],
      "number_observations_unique": 2095,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.6712
        }
      ]
    },
    {
      "resolution_limits": [2.00,1.95],
      "number_observations_unique": 2120,
      "quality_factors": [
        {
          "type": "CC(1/2)",
          "value": 0.6403
        }
      ]
    }
  ]

}
  

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


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