Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6036368f8f00bd7a1df7d92c8d29f923",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 65.995,
"b": 49.397,
"c": 61.691,
"alpha": 90.00,
"beta": 100.07,
"gamma": 90.00
},
"wavelengths": [0.97600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [26.77,2.09],
"number_observations_unique": 11465,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "R(meas)",
"value": 0.083
},
{
"type": "R(pim)",
"value": 0.057
},
{
"type": "I/SigI",
"value": 7.1
},
{
"type": "Completeness",
"value": 97.9
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.15,2.09],
"number_observations_unique": 808,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.252
},
{
"type": "R(meas)",
"value": 0.347
},
{
"type": "R(pim)",
"value": 0.239
},
{
"type": "I/SigI",
"value": 2.9
},
{
"type": "Completeness",
"value": 84.2
},
{
"type": "Redundancy",
"value": 2.7
},
{
"type": "CC(1/2)",
"value": 0.944
}
]
}
]
}