Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8bc2e21f3021614f2ed25c82e5b078aa",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 45.730,
"b": 74.243,
"c": 67.989,
"alpha": 90.000,
"beta": 96.075,
"gamma": 90.000
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.00,1.74],
"number_observations_unique": 45563,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 20.88
},
{
"type": "Completeness",
"value": 98.0
},
{
"type": "Redundancy",
"value": 4.6
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.77,1.74],
"number_observations_unique": 2261,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.396
},
{
"type": "R(pim)",
"value": 0.200
},
{
"type": "I/SigI",
"value": 2.21
},
{
"type": "Completeness",
"value": 97.4
},
{
"type": "Redundancy",
"value": 4.3
},
{
"type": "CC(1/2)",
"value": 0.968
}
]
}
]
}