Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "68a81e9a3aabd79ba6ae16998cfce39b",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 84.321,
"b": 84.321,
"c": 229.998,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97242],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [115.000,2.050],
"number_observations": 455737,
"number_observations_unique": 52888,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "R(meas)",
"value": 0.085
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 11.600
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 8.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.160,2.050],
"number_observations_unique": 7553,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.089
},
{
"type": "R(meas)",
"value": 2.220
},
{
"type": "R(pim)",
"value": 0.746
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 8.700
},
{
"type": "CC(1/2)",
"value": 0.730
}
]
},
{
"resolution_limits": [115.000,6.490],
"number_observations_unique": 1908,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 7.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}