Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "0d1cb2d46beb8ad44e96443d777b6324",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 76.629,
"b": 83.888,
"c": 61.643,
"alpha": 90.0,
"beta": 100.1,
"gamma": 90.0
},
"wavelengths": [0.97626],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.94,1.60],
"number_observations_unique": 50165,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "R(meas)",
"value": 0.092
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 10.8
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.63,1.60],
"number_observations_unique": 2492,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.286
},
{
"type": "R(meas)",
"value": 1.312
},
{
"type": "R(pim)",
"value": 0.497
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.771
}
]
}
]
}