Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f0f9777e807b37cf88749b179b22ac8d",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 207.651,
"b": 112.839,
"c": 188.356,
"alpha": 90.00,
"beta": 91.67,
"gamma": 90.00
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [188.276,2.155],
"number_observations": 1289154,
"number_observations_unique": 182573,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.087
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 12.2
},
{
"type": "Completeness",
"value": 93.8
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.331,2.155],
"number_observations": 65336,
"number_observations_unique": 9130,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.267
},
{
"type": "R(pim)",
"value": 0.509
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 0.647
}
]
},
{
"resolution_limits": [188.276,6.412],
"number_observations": 62672,
"number_observations_unique": 9128,
"quality_factors": [
{
"type": "R(merge)",
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},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 38.5
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}