Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a9edf8be48e9dbbe1d85cc892cf3cd14",
"space_group_name": "P 1",
"unit_cell": {
"a": 50.20,
"b": 77.19,
"c": 91.46,
"alpha": 75.88,
"beta": 85.63,
"gamma": 77.92
},
"wavelengths": [0.97915],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.56,2.72],
"number_observations_unique": 34082,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 10.9
},
{
"type": "Completeness",
"value": 97.5
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.85,2.72],
"number_observations_unique": 4551,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.607
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "CC(1/2)",
"value": 0.700
}
]
}
]
}