Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e3c7c943e7654a4d7c1085ed1235f41a",
"space_group_name": "I 41 2 2",
"unit_cell": {
"a": 95.922,
"b": 95.922,
"c": 187.429,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.96,2.00],
"number_observations": 398102,
"number_observations_unique": 29960,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.225
},
{
"type": "R(meas)",
"value": 0.234
},
{
"type": "R(pim)",
"value": 0.064
},
{
"type": "I/SigI",
"value": 8.6
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 13.3
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.05,2.00],
"number_observations": 25259,
"number_observations_unique": 2098,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.644
},
{
"type": "R(meas)",
"value": 2.760
},
{
"type": "R(pim)",
"value": 0.783
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Redundancy",
"value": 12.0
},
{
"type": "CC(1/2)",
"value": 0.421
}
]
}
]
}