Data quality metrics extracted from 3o3t.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": "b4cc3b4a32d047568419c7628c13ef35",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 42.360,
    "b": 63.985,
    "c": 82.803,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.54180],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [50.6300,1.69],
    "number_observations_unique": 25911,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.148
      },
      {
        "type": "I/SigI",
        "value": 166.319
      },
      {
        "type": "Completeness",
        "value": 98.590
      },
      {
        "type": "Redundancy",
        "value": 5.240
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.647,1.590],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.657
        }
      ]
    },
    {
      "resolution_limits": [1.713,1.647],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.607
        }
      ]
    },
    {
      "resolution_limits": [1.791,1.713],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.505
        }
      ]
    },
    {
      "resolution_limits": [1.885,1.791],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.361
        }
      ]
    },
    {
      "resolution_limits": [2.003,1.885],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.234
        }
      ]
    },
    {
      "resolution_limits": [2.158,2.003],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.181
        }
      ]
    },
    {
      "resolution_limits": [2.375,2.158],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.179
        }
      ]
    },
    {
      "resolution_limits": [2.719,2.375],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.178
        }
      ]
    },
    {
      "resolution_limits": [3.426,2.719],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.155
        }
      ]
    },
    {
      "resolution_limits": [50.6300,3.426],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.115
        }
      ]
    }
  ]

}
  

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


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