Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d8c7afb9bde49d4e78266884d7b21ea3",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 33.489,
"b": 70.008,
"c": 37.099,
"alpha": 90.00,
"beta": 97.72,
"gamma": 90.00
},
"wavelengths": [0.92019],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [70.01,1.44],
"number_observations_unique": 30580,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 20.8
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.47,1.44],
"number_observations_unique": 1569,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.201
},
{
"type": "R(pim)",
"value": 0.103
},
{
"type": "I/SigI",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.961
}
]
}
]
}