Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "55be3a4b613977ee211dc47f6bc68a13",
"space_group_name": "H 3",
"unit_cell": {
"a": 68.18,
"b": 68.18,
"c": 170.43,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.09,1.987],
"number_observations_unique": 20197,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1366
},
{
"type": "I/SigI",
"value": 22.24
},
{
"type": "Completeness",
"value": 99.11
}
]
},
"refln_shells": [
{
"resolution_limits": [2.04,1.987],
"number_observations_unique": 3054,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.485
},
{
"type": "I/SigI",
"value": 2.20
},
{
"type": "Completeness",
"value": 78.5
}
]
},
{
"resolution_limits": [2.09,2.04],
"number_observations_unique": 2914,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.406
},
{
"type": "I/SigI",
"value": 3.66
},
{
"type": "Completeness",
"value": 100
}
]
},
{
"resolution_limits": [2.16,2.09],
"number_observations_unique": 2916,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.360
},
{
"type": "I/SigI",
"value": 4.49
},
{
"type": "Completeness",
"value": 100
}
]
},
{
"resolution_limits": [2.22,2.16],
"number_observations_unique": 2682,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.329
},
{
"type": "I/SigI",
"value": 5.39
},
{
"type": "Completeness",
"value": 100
}
]
},
{
"resolution_limits": [2.29,2.22],
"number_observations_unique": 2729,
"quality_factors": [
{
"type": "R(merge)",
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},
{
"type": "I/SigI",
"value": 6.00
},
{
"type": "Completeness",
"value": 100
}
]
},
{
"resolution_limits": [2.37,2.29],
"number_observations_unique": 2610,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.251
},
{
"type": "I/SigI",
"value": 7.64
},
{
"type": "Completeness",
"value": 100
}
]
}
]
}