Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e755ef3a7c3b3c306a7ccf30e65d1d17",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 83.450,
"b": 83.450,
"c": 60.575,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97900,0.96408,0.97916,0.97931],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.00,1.60],
"number_observations_unique": 32231,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 38.61
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 10.9
}
]
},
"refln_shells": [
{
"resolution_limits": [1.66,1.60],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.302
},
{
"type": "I/SigI",
"value": 9.30
},
{
"type": "Completeness",
"value": 92.200
},
{
"type": "Redundancy",
"value": 10.4
}
]
},
{
"resolution_limits": [1.72,1.66],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.243
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.80,1.72],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.184
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.90,1.80],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.133
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.02,1.90],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.087
},
{
"type": "Completeness",
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}
]
},
{
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"quality_factors": [
{
"type": "R(merge)",
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},
{
"type": "Completeness",
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}
]
},
{
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"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "Completeness",
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}
]
},
{
"resolution_limits": [2.74,2.39],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "Completeness",
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}
]
},
{
"resolution_limits": [3.45,2.74],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "Completeness",
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}
]
},
{
"resolution_limits": [50.00,3.45],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "Completeness",
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}
]
}
]
}