Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "466382c3d9f4563f783ff9e9d63a048d",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 156.618,
"b": 97.879,
"c": 95.149,
"alpha": 90.0,
"beta": 125.2,
"gamma": 90.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [77.75,2.70],
"number_observations_unique": 30683,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.115
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 8.5
},
{
"type": "Completeness",
"value": 95.1
},
{
"type": "Redundancy",
"value": 6.0
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.85,2.70],
"number_observations_unique": 4113,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.774
},
{
"type": "R(pim)",
"value": 0.818
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Completeness",
"value": 88.6
},
{
"type": "CC(1/2)",
"value": 0.405
}
]
}
]
}