Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f899e3d6f93bd46e02aba62db8d29cc4",
"space_group_name": "P 1",
"unit_cell": {
"a": 46.28,
"b": 67.37,
"c": 91.05,
"alpha": 108.81,
"beta": 92.20,
"gamma": 106.72
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.52,1.60],
"number_observations_unique": 125194,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 10.4
},
{
"type": "Completeness",
"value": 96.2
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.64,1.60],
"number_observations_unique": 9094,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.162
},
{
"type": "R(pim)",
"value": 0.722
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "CC(1/2)",
"value": 0.524
}
]
}
]
}