Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "240fa401b25619140014906807de3447",
"space_group_name": "P 1",
"unit_cell": {
"a": 48.728,
"b": 59.593,
"c": 80.188,
"alpha": 79.65,
"beta": 82.00,
"gamma": 76.23
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [78.500,1.610],
"number_observations": 179910,
"number_observations_unique": 105862,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 9.800
},
{
"type": "Completeness",
"value": 95.300
},
{
"type": "Redundancy",
"value": 1.700
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [1.650,1.610],
"number_observations": 11312,
"number_observations_unique": 7621,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.595
},
{
"type": "R(meas)",
"value": 0.841
},
{
"type": "R(pim)",
"value": 0.595
},
{
"type": "I/SigI",
"value": 0.800
},
{
"type": "Completeness",
"value": 92.800
},
{
"type": "Redundancy",
"value": 1.500
},
{
"type": "CC(1/2)",
"value": 0.672
}
]
},
{
"resolution_limits": [78.500,7.200],
"number_observations": 2215,
"number_observations_unique": 1223,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 29.800
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 1.800
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}