Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "b011b2e7598878c41271ecac33adce43",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 105.30,
"b": 105.30,
"c": 160.26,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.09,1.44],
"number_observations_unique": 185339,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(meas)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 13.98
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 11.17
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.53,1.44],
"number_observations_unique": 29690,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.257
},
{
"type": "R(meas)",
"value": 2.379
},
{
"type": "I/SigI",
"value": 0.59
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "CC(1/2)",
"value": 0.576
}
]
},
{
"resolution_limits": [46.09,4.30],
"number_observations_unique": 7347,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(meas)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 54.61
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}