Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4987b97ff8563a1b477c8db9dc3f08c6",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 75.116,
"b": 136.516,
"c": 85.134,
"alpha": 90.00,
"beta": 115.09,
"gamma": 90.00
},
"wavelengths": [0.97531],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.19,1.75],
"number_observations_unique": 155949,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "I/SigI",
"value": 11.5
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.78,1.75],
"number_observations_unique": 7703,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.631
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.4
},
{
"type": "CC(1/2)",
"value": 0.815
}
]
}
]
}