Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "de3dabda6f22355f1a87b0add9a31e18",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 54.471,
"b": 81.881,
"c": 86.238,
"alpha": 90.000,
"beta": 96.825,
"gamma": 90.000
},
"wavelengths": [1.54301],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [24.37,2.1],
"number_observations_unique": 21917,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.09761
},
{
"type": "R(meas)",
"value": 0.1038
},
{
"type": "R(pim)",
"value": 0.0347
},
{
"type": "I/SigI",
"value": 14.36
},
{
"type": "Completeness",
"value": 99.52
},
{
"type": "Redundancy",
"value": 8.2
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.175,2.1],
"number_observations_unique": 2161,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.4165
},
{
"type": "R(meas)",
"value": 0.4554
},
{
"type": "R(pim)",
"value": 0.1816
},
{
"type": "I/SigI",
"value": 3.56
},
{
"type": "CC(1/2)",
"value": 0.944
}
]
}
]
}