Data quality metrics extracted from 3swl.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": "a060aed7dcd35ea1a85d8b134ba682c0",
  "space_group_name": "P 21 21 21",
  "unit_cell": {
    "a": 82.199,
    "b": 41.542,
    "c": 66.705,
    "alpha": 90.0,
    "beta": 90.0,
    "gamma": 90.0
  },
  "wavelengths": [1.54180],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [51.8000,2.35],
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.197
      },
      {
        "type": "I/SigI",
        "value": 196.431
      },
      {
        "type": "Completeness",
        "value": 98.830
      },
      {
        "type": "Redundancy",
        "value": 9.220
      }
    ]
  },
  "refln_shells": [
    {
      "resolution_limits": [1.957,1.890],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.841
        }
      ]
    },
    {
      "resolution_limits": [2.036,1.957],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.676
        }
      ]
    },
    {
      "resolution_limits": [2.128,2.036],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.541
        }
      ]
    },
    {
      "resolution_limits": [2.240,2.128],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.477
        }
      ]
    },
    {
      "resolution_limits": [2.381,2.240],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.390
        }
      ]
    },
    {
      "resolution_limits": [2.565,2.381],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.301
        }
      ]
    },
    {
      "resolution_limits": [2.823,2.565],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.234
        }
      ]
    },
    {
      "resolution_limits": [3.231,2.823],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.237
        }
      ]
    },
    {
      "resolution_limits": [4.071,3.231],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.197
        }
      ]
    },
    {
      "resolution_limits": [51.8000,4.071],
      "quality_factors": [
        {
          "type": "R(merge)",
          "value": 0.111
        }
      ]
    }
  ]

}
  

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


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