Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c134c7fa657aff4ceb76fe64148ad063",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 71.510,
"b": 71.510,
"c": 150.519,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.430,1.720],
"number_observations": 538388,
"number_observations_unique": 42301,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.100
},
{
"type": "R(meas)",
"value": 0.105
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 18.600
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 12.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.750,1.720],
"number_observations": 21614,
"number_observations_unique": 2032,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.053
},
{
"type": "R(meas)",
"value": 1.105
},
{
"type": "R(pim)",
"value": 0.325
},
{
"type": "I/SigI",
"value": 2.300
},
{
"type": "Completeness",
"value": 91.900
},
{
"type": "Redundancy",
"value": 10.600
},
{
"type": "CC(1/2)",
"value": 0.748
}
]
},
{
"resolution_limits": [29.430,9.100],
"number_observations": 3841,
"number_observations_unique": 356,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(meas)",
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},
{
"type": "R(pim)",
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},
{
"type": "I/SigI",
"value": 52.900
},
{
"type": "Completeness",
"value": 97.300
},
{
"type": "Redundancy",
"value": 10.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}