Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8da481e79e58f9bc144debc0e4f68f6a",
"space_group_name": "P 63",
"unit_cell": {
"a": 180.578,
"b": 180.578,
"c": 48.025,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97857],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.030,1.920],
"number_observations": 1433441,
"number_observations_unique": 69234,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "R(meas)",
"value": 0.081
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 22.500
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 20.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.970,1.920],
"number_observations": 100999,
"number_observations_unique": 4987,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.456
},
{
"type": "R(meas)",
"value": 1.493
},
{
"type": "R(pim)",
"value": 0.327
},
{
"type": "I/SigI",
"value": 2.100
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 20.300
},
{
"type": "CC(1/2)",
"value": 0.860
}
]
},
{
"resolution_limits": [48.030,8.570],
"number_observations": 16268,
"number_observations_unique": 850,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.054
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 61.900
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 19.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}