Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "706ead74f709dcc1c4573e7f1e4e9478",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 37.576,
"b": 52.182,
"c": 81.043,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.52,1.66],
"number_observations_unique": 18612,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(meas)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 24.93
},
{
"type": "Completeness",
"value": 93.5
},
{
"type": "Redundancy",
"value": 12.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.76,1.66],
"number_observations_unique": 2274,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.343
},
{
"type": "I/SigI",
"value": 5.68
},
{
"type": "Completeness",
"value": 73.4
},
{
"type": "Redundancy",
"value": 10.2
},
{
"type": "CC(1/2)",
"value": 0.96
}
]
}
]
}