Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "7e32ef02c590790a692ea584f7bbc69f",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 82.25,
"b": 82.25,
"c": 135.39,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.350,2.080],
"number_observations": 642639,
"number_observations_unique": 32548,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "R(meas)",
"value": 0.081
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 23.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.700
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.130,2.080],
"number_observations": 46220,
"number_observations_unique": 2386,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.451
},
{
"type": "R(meas)",
"value": 1.490
},
{
"type": "R(pim)",
"value": 0.337
},
{
"type": "I/SigI",
"value": 2.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.400
},
{
"type": "CC(1/2)",
"value": 0.829
}
]
},
{
"resolution_limits": [39.350,9.300],
"number_observations": 6150,
"number_observations_unique": 420,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 60.000
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 14.600
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}