Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "13378af06d83374b93b194fa6dfda161",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.447,
"b": 41.620,
"c": 72.401,
"alpha": 90.000,
"beta": 104.564,
"gamma": 90.000
},
"wavelengths": [0.88500],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.62,1.039],
"number_observations_unique": 117443,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "I/SigI",
"value": 14.18
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 7.02
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.10,1.04],
"number_observations_unique": 18662,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.463
},
{
"type": "I/SigI",
"value": 3.12
},
{
"type": "Completeness",
"value": 98.4
},
{
"type": "CC(1/2)",
"value": 0.902
}
]
}
]
}