Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "7d6ed6dde39c9c4d6950d8a1664a4b81",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 86.581,
"b": 128.198,
"c": 102.701,
"alpha": 90.000,
"beta": 93.078,
"gamma": 90.000
},
"wavelengths": [0.97856],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.62,2.00],
"number_observations_unique": 75252,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.096
},
{
"type": "R(meas)",
"value": 0.117
},
{
"type": "R(pim)",
"value": 0.066
},
{
"type": "I/SigI",
"value": 10.4
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 6.0
},
{
"type": "CC(1/2)",
"value": 0.99
}
]
},
"refln_shells": [
{
"resolution_limits": [2.04,2],
"number_observations_unique": 4432,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.621
},
{
"type": "R(pim)",
"value": 0.422
},
{
"type": "CC(1/2)",
"value": 0.79
}
]
}
]
}