Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c99565e2c88bd81fca2972e270945646",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 86.149,
"b": 56.216,
"c": 32.396,
"alpha": 90.00,
"beta": 95.34,
"gamma": 90.00
},
"wavelengths": [0.94055],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.02,1.09],
"number_observations": 397668,
"number_observations_unique": 56084,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.116
},
{
"type": "R(meas)",
"value": 0.125
},
{
"type": "R(pim)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 13.7
},
{
"type": "Completeness",
"value": 87.7
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.11,1.09],
"number_observations": 8118,
"number_observations_unique": 1330,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.720
},
{
"type": "R(meas)",
"value": 4.051
},
{
"type": "R(pim)",
"value": 1.577
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.249
}
]
}
]
}