Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dfb0f5fec4208aec4e3d97700dccecaf",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 87.717,
"b": 63.950,
"c": 91.746,
"alpha": 90.00,
"beta": 98.64,
"gamma": 90.00
},
"wavelengths": [1.54178],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [90.7,1.95],
"number_observations_unique": 72557,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.099
},
{
"type": "I/SigI",
"value": 10.1
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 4.9
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.0,1.95],
"number_observations_unique": 4318,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.213
},
{
"type": "I/SigI",
"value": 3.8
},
{
"type": "Completeness",
"value": 95.9
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.941
}
]
}
]
}