Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "258b5fc3c00f6f6d06af80de9d5c3846",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 217.936,
"b": 70.888,
"c": 144.387,
"alpha": 90.000,
"beta": 104.861,
"gamma": 90.000
},
"wavelengths": [0.95400],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.43,2.5],
"number_observations_unique": 73277,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.05929
},
{
"type": "R(meas)",
"value": 0.08385
},
{
"type": "R(pim)",
"value": 0.05929
},
{
"type": "I/SigI",
"value": 9.24
},
{
"type": "Completeness",
"value": 98.76
},
{
"type": "Redundancy",
"value": 2.0
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.589,2.5],
"number_observations_unique": 7243,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.4452
},
{
"type": "R(meas)",
"value": 0.6296
},
{
"type": "R(pim)",
"value": 0.4452
},
{
"type": "I/SigI",
"value": 2.03
},
{
"type": "CC(1/2)",
"value": 0.679
}
]
}
]
}