Data quality metrics extracted from 1jch.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": "7dcfeb4d74a364f06738bfe558cf626b",
  "space_group_name": "P 1 21 1",
  "unit_cell": {
    "a": 66.986,
    "b": 195.733,
    "c": 85.124,
    "alpha": 90.00,
    "beta": 113.22,
    "gamma": 90.00
  },
  "wavelengths": [1.03700],
  "anisotropic_diffraction": false,
  "overall_refln_statistics": {
    "resolution_limits": [20.0,3.02],
    "number_observations_unique": 37014,
    "quality_factors": [
      {
        "type": "R(merge)",
        "value": 0.0670000
      },
      {
        "type": "I/SigI",
        "value": 19.5
      },
      {
        "type": "Completeness",
        "value": 94.1
      },
      {
        "type": "Redundancy",
        "value": 3.2
      }
    ]
  }
}
  

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


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