Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d2a98c82281623338e4947f4d27e22f0",
"space_group_name": "P 61",
"unit_cell": {
"a": 104.079,
"b": 104.079,
"c": 56.666,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [23.650,1.500],
"number_observations": 456974,
"number_observations_unique": 55972,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "R(meas)",
"value": 0.079
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 12.600
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 8.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.530,1.500],
"number_observations": 14936,
"number_observations_unique": 2748,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.557
},
{
"type": "R(meas)",
"value": 1.724
},
{
"type": "R(pim)",
"value": 0.731
},
{
"type": "I/SigI",
"value": 0.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.400
},
{
"type": "CC(1/2)",
"value": 0.683
}
]
},
{
"resolution_limits": [23.650,8.220],
"number_observations": 3890,
"number_observations_unique": 354,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 42.800
},
{
"type": "Completeness",
"value": 95.200
},
{
"type": "Redundancy",
"value": 11.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}