Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "441e0d240398f650a78ef54fa297e78a",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 86.363,
"b": 56.314,
"c": 32.462,
"alpha": 90.0,
"beta": 95.4,
"gamma": 90.0
},
"wavelengths": [0.94055],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.13,1.06],
"number_observations": 408236,
"number_observations_unique": 64494,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "R(meas)",
"value": 0.087
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 11.7
},
{
"type": "Completeness",
"value": 92.0
},
{
"type": "Redundancy",
"value": 6.3
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.08,1.06],
"number_observations": 5895,
"number_observations_unique": 1604,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.600
},
{
"type": "R(meas)",
"value": 1.854
},
{
"type": "R(pim)",
"value": 0.922
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.426
}
]
}
]
}