Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d20e2980ae8671119c79c82c7dd37e8b",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 95.778,
"b": 45.659,
"c": 51.073,
"alpha": 90.00,
"beta": 100.38,
"gamma": 90.00
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.15,1.50],
"number_observations_unique": 35000,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.067
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 10.3
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.521,1.50],
"number_observations_unique": 1775,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.239
},
{
"type": "R(meas)",
"value": 2.674
},
{
"type": "R(pim)",
"value": 1.450
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.329
}
]
}
]
}