Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "150d95baabd7983127639ab92c4813ad",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 208.146,
"b": 113.021,
"c": 188.617,
"alpha": 90.00,
"beta": 91.93,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [188.510,2.190],
"number_observations": 1985531,
"number_observations_unique": 172129,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.143
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 12.2
},
{
"type": "Completeness",
"value": 94.8
},
{
"type": "Redundancy",
"value": 11.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.381,2.190],
"number_observations": 98514,
"number_observations_unique": 8606,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.744
},
{
"type": "R(pim)",
"value": 0.538
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Redundancy",
"value": 11.4
},
{
"type": "CC(1/2)",
"value": 0.638
}
]
},
{
"resolution_limits": [188.510,6.552],
"number_observations": 99766,
"number_observations_unique": 8605,
"quality_factors": [
{
"type": "R(merge)",
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},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 37.2
},
{
"type": "Redundancy",
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},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}