Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7a2e00f95d1c3a35a7298c85a3e8cd43",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 71.353,
"b": 71.353,
"c": 196.924,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [67.090,1.900],
"number_observations": 888528,
"number_observations_unique": 41147,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.423
},
{
"type": "R(meas)",
"value": 0.433
},
{
"type": "R(pim)",
"value": 0.091
},
{
"type": "I/SigI",
"value": 7.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 21.600
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.000,1.900],
"number_observations": 132979,
"number_observations_unique": 5860,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.590
},
{
"type": "R(meas)",
"value": 4.693
},
{
"type": "R(pim)",
"value": 0.969
},
{
"type": "I/SigI",
"value": 0.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 22.700
},
{
"type": "CC(1/2)",
"value": 0.563
}
]
},
{
"resolution_limits": [67.090,6.010],
"number_observations": 27593,
"number_observations_unique": 1511,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(meas)",
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},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 27.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 18.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}