Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "798fc181dde9ad701926d6025c279d60",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 72.811,
"b": 85.091,
"c": 97.162,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.10200],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.63],
"number_observations_unique": 6639,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 4.2
},
{
"type": "Completeness",
"value": 98
},
{
"type": "Redundancy",
"value": 12
},
{
"type": "CC(1/2)",
"value": 1.0
}
]
},
"refln_shells": [
{
"resolution_limits": [2.76,2.66],
"number_observations_unique": 332,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.047
},
{
"type": "R(pim)",
"value": 2.9
},
{
"type": "I/SigI",
"value": 0.2
},
{
"type": "Completeness",
"value": 84.9
},
{
"type": "Redundancy",
"value": 9.6
}
]
}
]
}