Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "917cbc42df783f4224ff50007821bbf1",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 66.321,
"b": 124.244,
"c": 71.227,
"alpha": 90.000,
"beta": 101.015,
"gamma": 90.000
},
"wavelengths": [0.98010],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.482,1.77],
"number_observations_unique": 107302,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.099
},
{
"type": "R(meas)",
"value": 0.117
},
{
"type": "R(pim)",
"value": 0.061
},
{
"type": "I/SigI",
"value": 10.6
},
{
"type": "Completeness",
"value": 97.7
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [46.44,9.69],
"number_observations_unique": 692,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [1.80,1.77],
"number_observations_unique": 5218,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.371
},
{
"type": "R(meas)",
"value": 1.617
},
{
"type": "R(pim)",
"value": 0.848
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 0.663
}
]
}
]
}