Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "669037689021bf9be5c34770a0c06849",
"space_group_name": "P 1",
"unit_cell": {
"a": 58.992,
"b": 70.150,
"c": 85.128,
"alpha": 102.34,
"beta": 96.21,
"gamma": 112.56
},
"wavelengths": [0.91260],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [81.190,1.820],
"number_observations": 339509,
"number_observations_unique": 103427,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "R(meas)",
"value": 0.086
},
{
"type": "R(pim)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 7.200
},
{
"type": "Completeness",
"value": 95.500
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.850,1.820],
"number_observations": 13360,
"number_observations_unique": 4928,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.626
},
{
"type": "R(meas)",
"value": 2.049
},
{
"type": "R(pim)",
"value": 1.218
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 90.400
},
{
"type": "Redundancy",
"value": 2.700
},
{
"type": "CC(1/2)",
"value": 0.292
}
]
},
{
"resolution_limits": [81.190,9.950],
"number_observations": 2478,
"number_observations_unique": 640,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "R(meas)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 33.500
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 3.900
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}