Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "78b78c0a13fc1be6450a04637167f126",
"space_group_name": "P 61",
"unit_cell": {
"a": 62.100,
"b": 62.100,
"c": 301.406,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.770,2.250],
"number_observations": 163129,
"number_observations_unique": 31095,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "R(pim)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 14.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.200
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.320,2.250],
"number_observations": 9067,
"number_observations_unique": 2816,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.637
},
{
"type": "R(pim)",
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},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.516
}
]
},
{
"resolution_limits": [43.770,9.000],
"number_observations": 2605,
"number_observations_unique": 504,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 44.400
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
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},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}