Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "993a11af964a051d1e56fd3da688b889",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 103.244,
"b": 65.273,
"c": 138.284,
"alpha": 90.00,
"beta": 91.17,
"gamma": 90.00
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40,3.3],
"number_observations_unique": 28108,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.148
},
{
"type": "I/SigI",
"value": 7.7
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 4.4
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [3.42,3.30],
"number_observations_unique": 2727,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.811
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 97.4
},
{
"type": "Redundancy",
"value": 4.1
},
{
"type": "CC(1/2)",
"value": 0.872
}
]
}
]
}