Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "757a5c6d4b1ccb9e8fa1a4a3cc260d3d",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 41.825,
"b": 50.853,
"c": 125.488,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98030],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.71,1.20],
"number_observations_unique": 84143,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.096
},
{
"type": "R(meas)",
"value": 0.102
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 12.8
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 8.6
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.223,1.200],
"number_observations_unique": 4207,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.779
},
{
"type": "R(meas)",
"value": 0.834
},
{
"type": "R(pim)",
"value": 0.292
},
{
"type": "I/SigI",
"value": 4.6
},
{
"type": "Completeness",
"value": 94.6
},
{
"type": "Redundancy",
"value": 7.7
},
{
"type": "CC(1/2)",
"value": 0.888
}
]
}
]
}