Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c7cd8f4b7ee48a8a0d7bf658846e8fad",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 72.665,
"b": 89.210,
"c": 159.235,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54200,3.07000,4.05000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33,1.84],
"number_observations_unique": 45276,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.11
},
{
"type": "I/SigI",
"value": 14.7
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 11.5
},
{
"type": "CC(1/2)",
"value": 1
}
]
},
"refln_shells": [
{
"resolution_limits": [1.88,1.84],
"number_observations_unique": 2766,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.58
},
{
"type": "CC(1/2)",
"value": 0.83
}
]
},
{
"resolution_limits": [2.32,2.20],
"number_observations_unique": 2822,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.33
}
]
}
]
}