Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fbcd365d99b1293bea76ec46ec92c9fe",
"space_group_name": "P 63 2 2",
"unit_cell": {
"a": 158.568,
"b": 158.568,
"c": 152.381,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.130,1.650],
"number_observations": 2688900,
"number_observations_unique": 134788,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.172
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 12.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.900
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.680,1.650],
"number_observations": 134460,
"number_observations_unique": 6610,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.834
},
{
"type": "R(pim)",
"value": 0.412
},
{
"type": "I/SigI",
"value": 2.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 20.300
},
{
"type": "CC(1/2)",
"value": 0.783
}
]
},
{
"resolution_limits": [49.130,9.040],
"number_observations": 17515,
"number_observations_unique": 977,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 29.100
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 17.900
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
}
]
}