Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dc52ed328302e26ab4fdef3af700328d",
"space_group_name": "P 3",
"unit_cell": {
"a": 85.00,
"b": 85.00,
"c": 120.78,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00800],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.750],
"number_observations_unique": 25386,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "I/SigI",
"value": 15.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.79
}
]
},
"refln_shells": [
{
"resolution_limits": [2.850,2.750],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.870
},
{
"type": "I/SigI",
"value": 2.470
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [3.000,2.850],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.682
},
{
"type": "I/SigI",
"value": 3.250
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [3.300,3.000],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.376
},
{
"type": "I/SigI",
"value": 5.770
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [3.800,3.300],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.171
},
{
"type": "I/SigI",
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},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [4.300,3.800],
"quality_factors": [
{
"type": "R(merge)",
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},
{
"type": "I/SigI",
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},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [5.900,4.300],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 27.540
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [8.000,5.900],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 35.590
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [12.000,8.000],
"quality_factors": [
{
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"value": 0.031
},
{
"type": "I/SigI",
"value": 47.670
},
{
"type": "Completeness",
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}
]
},
{
"resolution_limits": [50,12.000],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 53.270
},
{
"type": "Completeness",
"value": 98.100
}
]
}
]
}