Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bdaa4c897ab69ef85bd593f2c139c297",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 99.36,
"b": 99.36,
"c": 50.03,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.680,2.350],
"number_observations_unique": 12122,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.198
},
{
"type": "R(meas)",
"value": 0.209
},
{
"type": "R(pim)",
"value": 0.067
},
{
"type": "I/SigI",
"value": 8.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 9.700
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.410,2.350],
"number_observations_unique": 878,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.570
},
{
"type": "R(meas)",
"value": 1.653
},
{
"type": "R(pim)",
"value": 0.513
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.200
},
{
"type": "CC(1/2)",
"value": 0.485
}
]
},
{
"resolution_limits": [49.680,10.510],
"number_observations_unique": 164,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "R(meas)",
"value": 0.076
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 7.500
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}