Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b092effa0db427d6a05ee2f2a3651cc2",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 45.404,
"b": 73.009,
"c": 53.069,
"alpha": 90.00,
"beta": 110.06,
"gamma": 90.00
},
"wavelengths": [1.54200],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,1.579],
"number_observations_unique": 44501,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 21.9
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 4.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.67,1.58],
"number_observations_unique": 7161,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.172
},
{
"type": "I/SigI",
"value": 7.2
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.965
}
]
}
]
}