Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d1ed7b5876f24e2ad4272e1c51a275a4",
"space_group_name": "P 1",
"unit_cell": {
"a": 33.864,
"b": 44.448,
"c": 67.306,
"alpha": 72.26,
"beta": 84.44,
"gamma": 77.11
},
"wavelengths": [0.97923],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.44,2.80],
"number_observations": 29060,
"number_observations_unique": 8734,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "R(meas)",
"value": 0.093
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 10.7
},
{
"type": "Completeness",
"value": 97.5
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.95,2.80],
"number_observations": 4229,
"number_observations_unique": 1268,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.495
},
{
"type": "R(meas)",
"value": 0.592
},
{
"type": "R(pim)",
"value": 0.319
},
{
"type": "I/SigI",
"value": 2.5
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.886
}
]
}
]
}