Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "88982099f9745af50897632b1ff4ba65",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 40.807,
"b": 72.465,
"c": 42.053,
"alpha": 90.000,
"beta": 99.092,
"gamma": 90.000
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [20.88,1.91],
"number_observations_unique": 36869,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.186
},
{
"type": "R(pim)",
"value": 0.063
},
{
"type": "I/SigI",
"value": 10.1
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 9.5
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.97,1.91],
"number_observations_unique": 1771,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.862
},
{
"type": "R(pim)",
"value": 0.301
},
{
"type": "I/SigI",
"value": 2.4
},
{
"type": "Completeness",
"value": 95.9
},
{
"type": "CC(1/2)",
"value": 0.855
}
]
}
]
}