Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "344dd59e8b3aca9bad6b5ae9546a10c5",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 115.365,
"b": 61.850,
"c": 46.541,
"alpha": 90.00,
"beta": 92.36,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.501,1.88],
"number_observations_unique": 25780,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.123
},
{
"type": "R(pim)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 21.3
},
{
"type": "Completeness",
"value": 96.8
},
{
"type": "Redundancy",
"value": 6.3
}
]
},
"refln_shells": [
{
"resolution_limits": [1.92,1.88],
"number_observations_unique": 2062,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.808
},
{
"type": "R(pim)",
"value": 0.432
},
{
"type": "I/SigI",
"value": 3.0
},
{
"type": "Completeness",
"value": 78.5
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.681
}
]
}
]
}