Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "37d107e38810e5476cf1a3daf9bbe036",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.801,
"b": 79.329,
"c": 55.848,
"alpha": 90.000,
"beta": 110.994,
"gamma": 90.000
},
"wavelengths": [0.97872],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.0,1.53],
"number_observations_unique": 54702,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 34.8
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 7.6
},
{
"type": "CC(1/2)",
"value": 0.93
}
]
},
"refln_shells": [
{
"resolution_limits": [1.56,1.53],
"number_observations_unique": 2733,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.371
},
{
"type": "R(pim)",
"value": 0.157
},
{
"type": "I/SigI",
"value": 5.0
},
{
"type": "Completeness",
"value": 99.0
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.93
}
]
}
]
}