Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c584cfbdac0b31b978405818f97733f4",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 114.643,
"b": 53.607,
"c": 45.029,
"alpha": 90.00,
"beta": 101.86,
"gamma": 90.00
},
"wavelengths": [0.99000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.04],
"number_observations_unique": 16918,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "I/SigI",
"value": 20.66
},
{
"type": "Completeness",
"value": 99.0
},
{
"type": "Redundancy",
"value": 4.0
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
},
"refln_shells": [
{
"resolution_limits": [2.08,2.04],
"number_observations_unique": 823,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.393
},
{
"type": "R(pim)",
"value": 0.222
},
{
"type": "I/SigI",
"value": 2.15
},
{
"type": "CC(1/2)",
"value": 0.869
}
]
}
]
}