Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "567bda967e6708b253d8f049dbc4b999",
"space_group_name": "P 1",
"unit_cell": {
"a": 45.674,
"b": 82.406,
"c": 84.445,
"alpha": 70.107,
"beta": 77.275,
"gamma": 80.304
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30,2.28],
"number_observations_unique": 50563,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.102
},
{
"type": "R(pim)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 13.3
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.983
}
]
},
"refln_shells": [
{
"resolution_limits": [2.34,2.28],
"number_observations_unique": 1817,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.492
},
{
"type": "R(pim)",
"value": 0.293
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "CC(1/2)",
"value": 0.868
}
]
}
]
}