Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7a4c723d7c843540cb44f749843c90ab",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 57.846,
"b": 57.846,
"c": 396.784,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [132.290,1.860],
"number_observations": 639006,
"number_observations_unique": 34907,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.180
},
{
"type": "R(meas)",
"value": 0.185
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 11.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 18.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.910,1.860],
"number_observations": 48069,
"number_observations_unique": 2472,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.638
},
{
"type": "R(meas)",
"value": 3.736
},
{
"type": "R(pim)",
"value": 0.845
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.400
},
{
"type": "CC(1/2)",
"value": 0.576
}
]
},
{
"resolution_limits": [132.290,8.320],
"number_observations": 7604,
"number_observations_unique": 547,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "R(meas)",
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},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 35.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.900
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}