Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ddcf32cbb25c9791e9f3bd15ae83dfdd",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.710,
"b": 57.366,
"c": 60.749,
"alpha": 90.000,
"beta": 110.831,
"gamma": 90.000
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,1.906],
"number_observations_unique": 22230,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "I/SigI",
"value": 19.93
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 7.7
},
{
"type": "CC(1/2)",
"value": 0.9698
}
]
},
"refln_shells": [
{
"resolution_limits": [1.95,1.906],
"number_observations_unique": 1081,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.696
},
{
"type": "R(meas)",
"value": 0.775
},
{
"type": "R(pim)",
"value": 0.333
},
{
"type": "I/SigI",
"value": 2.347
},
{
"type": "CC(1/2)",
"value": 0.843
}
]
}
]
}