Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ae88cee160f1b204a3a25a7ab1524534",
"space_group_name": "P 1",
"unit_cell": {
"a": 49.270,
"b": 59.910,
"c": 80.011,
"alpha": 79.55,
"beta": 81.38,
"gamma": 75.74
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.420,1.710],
"number_observations": 153246,
"number_observations_unique": 89368,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.026
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 11.700
},
{
"type": "Completeness",
"value": 95.400
},
{
"type": "Redundancy",
"value": 1.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.750,1.710],
"number_observations": 10747,
"number_observations_unique": 6536,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.416
},
{
"type": "R(meas)",
"value": 0.588
},
{
"type": "R(pim)",
"value": 0.416
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 94.200
},
{
"type": "Redundancy",
"value": 1.600
},
{
"type": "CC(1/2)",
"value": 0.811
}
]
},
{
"resolution_limits": [41.420,7.650],
"number_observations": 1872,
"number_observations_unique": 1027,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.016
},
{
"type": "R(meas)",
"value": 0.022
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 41.300
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}