Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e61bd363bb81b7809b3ce1afe61f1ca2",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 86.58,
"b": 93.60,
"c": 106.35,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97121],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.0,1.650],
"number_observations_unique": 101635,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 21.17
},
{
"type": "Completeness",
"value": 97.4
}
]
},
"refln_shells": [
{
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"quality_factors": [
{
"type": "R(merge)",
"value": 0.470
},
{
"type": "I/SigI",
"value": 3.360
},
{
"type": "Completeness",
"value": 99.500
}
]
},
{
"resolution_limits": [1.870,1.750],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.288
},
{
"type": "I/SigI",
"value": 5.480
},
{
"type": "Completeness",
"value": 99.200
}
]
},
{
"resolution_limits": [2.010,1.870],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.166
},
{
"type": "I/SigI",
"value": 9.190
},
{
"type": "Completeness",
"value": 98.800
}
]
},
{
"resolution_limits": [2.210,2.010],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "I/SigI",
"value": 16.240
},
{
"type": "Completeness",
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}
]
},
{
"resolution_limits": [2.470,2.210],
"quality_factors": [
{
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},
{
"type": "I/SigI",
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},
{
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}
]
},
{
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"quality_factors": [
{
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},
{
"type": "I/SigI",
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},
{
"type": "Completeness",
"value": 96.500
}
]
},
{
"resolution_limits": [3.480,2.850],
"quality_factors": [
{
"type": "R(merge)",
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},
{
"type": "I/SigI",
"value": 42.420
},
{
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}
]
},
{
"resolution_limits": [4.910,3.480],
"quality_factors": [
{
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},
{
"type": "I/SigI",
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},
{
"type": "Completeness",
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}
]
},
{
"resolution_limits": [50.000,4.910],
"quality_factors": [
{
"type": "R(merge)",
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},
{
"type": "I/SigI",
"value": 72.970
},
{
"type": "Completeness",
"value": 89.400
}
]
}
]
}