Data quality metrics extracted from 3o48.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": "7b195d04ce8ced66130d80f74b3ae66f",
  "space_group_name": "P 43 21 2",
  "unit_cell": {
    "a": 46.02,
    "b": 46.02,
    "c": 139.22,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.00000],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50,1.75],
    "number_observations_unique": 15603,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.324
      },
      {
        "type": "I/SigI",
        "value": 10.21
      },
      {
        "type": "Completeness",
        "value": 95.8
      },
      {
        "type": "Redundancy",
        "value": 23.26
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.80,1.75],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.51
        },
        {
          "type": "I/SigI",
          "value": 6.84
        },
        {
          "type": "Redundancy",
          "value": 26.16
        }
      ]
    },
    {
      "resolution_limits": [1.90,1.80],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.45
        },
        {
          "type": "I/SigI",
          "value": 7.94
        },
        {
          "type": "Redundancy",
          "value": 25.33
        }
      ]
    },
    {
      "resolution_limits": [2.00,1.90],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.44
        },
        {
          "type": "I/SigI",
          "value": 9.13
        },
        {
          "type": "Redundancy",
          "value": 23.99
        }
      ]
    },
    {
      "resolution_limits": [2.50,2.00],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.34
        },
        {
          "type": "I/SigI",
          "value": 10.64
        },
        {
          "type": "Redundancy",
          "value": 23.13
        }
      ]
    },
    {
      "resolution_limits": [4.00,2.50],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.32
        },
        {
          "type": "I/SigI",
          "value": 11.74
        },
        {
          "type": "Redundancy",
          "value": 22.22
        }
      ]
    },
    {
      "resolution_limits": [5.00,4.00],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.31
        },
        {
          "type": "I/SigI",
          "value": 11.95
        },
        {
          "type": "Redundancy",
          "value": 21.73
        }
      ]
    }
  ]

}
  

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


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