Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d282e88bfde9fede9179d6c89de9b68e",
"space_group_name": "P 41 21 2",
"unit_cell": {
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"b": 81.020,
"c": 127.617,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
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"number_observations": 108208,
"number_observations_unique": 19528,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "I/SigI",
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},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 5.500
}
]
},
"refln_shells": [
{
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"number_observations_unique": 1935,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.552
},
{
"type": "Completeness",
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},
{
"type": "Redundancy",
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}
]
},
{
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"quality_factors": [
{
"type": "R(merge)",
"value": 0.434
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
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}
]
},
{
"resolution_limits": [2.590,2.480],
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"quality_factors": [
{
"type": "R(merge)",
"value": 0.315
},
{
"type": "Completeness",
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},
{
"type": "Redundancy",
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}
]
},
{
"resolution_limits": [2.730,2.590],
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"quality_factors": [
{
"type": "R(merge)",
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},
{
"type": "Completeness",
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},
{
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}
]
},
{
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"quality_factors": [
{
"type": "R(merge)",
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},
{
"type": "Completeness",
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},
{
"type": "Redundancy",
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}
]
},
{
"resolution_limits": [3.120,2.900],
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"quality_factors": [
{
"type": "R(merge)",
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},
{
"type": "Completeness",
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},
{
"type": "Redundancy",
"value": 5.600
}
]
},
{
"resolution_limits": [3.440,3.120],
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"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "Completeness",
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},
{
"type": "Redundancy",
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}
]
},
{
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"quality_factors": [
{
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"value": 0.054
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 5.500
}
]
},
{
"resolution_limits": [4.950,3.930],
"number_observations_unique": 1986,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
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}
]
},
{
"resolution_limits": [50.000,4.950],
"number_observations_unique": 2090,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
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}
]
}
]
}