Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e3e566bfedb8e17534686d684f99e728",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 158.533,
"b": 158.533,
"c": 210.820,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [2.75000,3.14000,3.54000,4.35000,4.50000,5.16000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [210.82,2.37],
"number_observations_unique": 124385,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.215
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 11.6
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 59.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.41,2.37],
"number_observations_unique": 6112,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.369
},
{
"type": "R(pim)",
"value": 0.796
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 45.0
},
{
"type": "CC(1/2)",
"value": 0.204
}
]
}
]
}