Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4f151fd6781c8416389d21ecf198fb70",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 97.138,
"b": 97.138,
"c": 233.432,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91740],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [89.68,1.650],
"number_observations_unique": 134736,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.108
},
{
"type": "R(meas)",
"value": 0.111
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 19.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 17.700
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.680,1.650],
"number_observations": 93051,
"number_observations_unique": 6564,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.056
},
{
"type": "R(meas)",
"value": 2.132
},
{
"type": "R(pim)",
"value": 0.558
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 14.200
},
{
"type": "CC(1/2)",
"value": 0.577
}
]
},
{
"resolution_limits": [50.020,9.040],
"number_observations": 15608,
"number_observations_unique": 990,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 74.100
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 15.800
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}