Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d26c5940659f6cb65b39d27c8bc68bd0",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 87.75,
"b": 93.84,
"c": 105.77,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.0,1.600],
"number_observations_unique": 115264,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 22.16
},
{
"type": "Completeness",
"value": 99.8
}
]
},
"refln_shells": [
{
"resolution_limits": [1.700,1.600],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.497
},
{
"type": "I/SigI",
"value": 3.770
},
{
"type": "Completeness",
"value": 99.200
}
]
},
{
"resolution_limits": [1.810,1.700],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.275
},
{
"type": "I/SigI",
"value": 6.640
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.960,1.810],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.156
},
{
"type": "I/SigI",
"value": 11.010
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.140,1.960],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "I/SigI",
"value": 18.950
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.400,2.140],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 27.080
},
{
"type": "Completeness",
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}
]
},
{
"resolution_limits": [2.770,2.400],
"quality_factors": [
{
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"value": 0.040
},
{
"type": "I/SigI",
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},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [3.380,2.770],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 44.500
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [4.770,3.380],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 52.910
},
{
"type": "Completeness",
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}
]
},
{
"resolution_limits": [50.000,4.770],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 53.210
},
{
"type": "Completeness",
"value": 98.900
}
]
}
]
}