Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "d3ea18e3b6a9d8a4f05215a0b06b84fb",
"space_group_name": "P 1",
"unit_cell": {
"a": 46.34,
"b": 47.56,
"c": 50.44,
"alpha": 113.51,
"beta": 89.76,
"gamma": 91.77
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [32.87,1.66],
"number_observations_unique": 85746,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.104
},
{
"type": "I/SigI",
"value": 10.3
},
{
"type": "Completeness",
"value": 94.8
},
{
"type": "Redundancy",
"value": 3.6
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.719,1.66],
"number_observations_unique": 4452,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.484
},
{
"type": "I/SigI",
"value": 0.9
},
{
"type": "CC(1/2)",
"value": 0.336
}
]
}
]
}