Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "757ff64cf9325257021e62665e6239f7",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.731,
"b": 60.585,
"c": 32.441,
"alpha": 90.00,
"beta": 92.63,
"gamma": 90.00
},
"wavelengths": [0.94054],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.52,1.71],
"number_observations": 105724,
"number_observations_unique": 15151,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.243
},
{
"type": "R(meas)",
"value": 0.263
},
{
"type": "R(pim)",
"value": 0.099
},
{
"type": "I/SigI",
"value": 8.0
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [1.74,1.71],
"number_observations": 5188,
"number_observations_unique": 764,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.791
},
{
"type": "R(meas)",
"value": 3.026
},
{
"type": "R(pim)",
"value": 1.156
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.291
}
]
}
]
}