Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cd9b1ae038fa55a0a7edf4f130efdeee",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 86.71,
"b": 56.40,
"c": 64.73,
"alpha": 90.00,
"beta": 94.43,
"gamma": 90.00
},
"wavelengths": [0.94054],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.24,1.32],
"number_observations": 493170,
"number_observations_unique": 71753,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "R(meas)",
"value": 0.077
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 12.3
},
{
"type": "Completeness",
"value": 98.4
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.35,1.32],
"number_observations": 35393,
"number_observations_unique": 5224,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.661
},
{
"type": "R(meas)",
"value": 2.879
},
{
"type": "R(pim)",
"value": 1.088
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.365
}
]
}
]
}