Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "1225e023ad79758fff2e39ba05c9ab72",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 142.346,
"b": 142.346,
"c": 213.234,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.930,3.307],
"number_observations_unique": 17940,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.115
},
{
"type": "R(meas)",
"value": 0.118
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 11.1
},
{
"type": "Completeness",
"value": 93.4
},
{
"type": "Redundancy",
"value": 19.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [3.659,3.307],
"number_observations_unique": 901,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.987
},
{
"type": "R(meas)",
"value": 2.040
},
{
"type": "R(pim)",
"value": 0.455
},
{
"type": "I/SigI",
"value": 1.8
},
{
"type": "CC(1/2)",
"value": 0.012
}
]
}
]
}