Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d223e88d222933cc83ee0a36d5ec66a0",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 123.971,
"b": 56.866,
"c": 171.888,
"alpha": 90.00,
"beta": 96.44,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.00,2.80],
"number_observations_unique": 29585,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.133
},
{
"type": "I/SigI",
"value": 5.5
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [2.95,2.80],
"number_observations_unique": 4288,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.620
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 99.0
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.761
}
]
}
]
}