Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "049af38bdbc2c8a0fd225733f7d8cf6d",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.262,
"b": 41.425,
"c": 72.274,
"alpha": 90.0,
"beta": 104.5,
"gamma": 90.0
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.425,1.097],
"number_observations_unique": 97931,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.05
},
{
"type": "I/SigI",
"value": 12.32
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 3.58
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.16,1.10],
"number_observations_unique": 15202,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.435
},
{
"type": "I/SigI",
"value": 2.49
},
{
"type": "Completeness",
"value": 95.4
},
{
"type": "Redundancy",
"value": 3.55
},
{
"type": "CC(1/2)",
"value": 0.821
}
]
}
]
}