Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "658e5272dba1b2ed7b15c6d1352f26de",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 179.64,
"b": 220.65,
"c": 101.14,
"alpha": 90.00,
"beta": 99.09,
"gamma": 90.00
},
"wavelengths": [0.96860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.93,2.26],
"number_observations_unique": 180631,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.108
},
{
"type": "I/SigI",
"value": 9.2
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.30,2.26],
"number_observations_unique": 9050,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.844
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.527
}
]
}
]
}