Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0a2312bebdabd4f2e8499ec516fff0ea",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 86.043,
"b": 71.902,
"c": 52.015,
"alpha": 90.00,
"beta": 100.14,
"gamma": 90.00
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [21.96,2.00],
"number_observations": 139425,
"number_observations_unique": 21090,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "R(meas)",
"value": 0.081
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 23.7
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.05,2.00],
"number_observations": 9847,
"number_observations_unique": 1484,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.391
},
{
"type": "R(meas)",
"value": 0.425
},
{
"type": "R(pim)",
"value": 0.164
},
{
"type": "I/SigI",
"value": 4.9
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 0.926
}
]
}
]
}