Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b9914e33a396634e80cd0cba25409254",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 99.309,
"b": 55.521,
"c": 44.614,
"alpha": 90.00,
"beta": 103.89,
"gamma": 90.00
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [100,1.65],
"number_observations_unique": 27327,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(meas)",
"value": 0.054
},
{
"type": "R(pim)",
"value": 0.02
},
{
"type": "I/SigI",
"value": 19.0
},
{
"type": "Completeness",
"value": 96.1
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.71,1.65],
"number_observations_unique": 2452,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.271
},
{
"type": "R(meas)",
"value": 0.465
},
{
"type": "R(pim)",
"value": 0.187
},
{
"type": "I/SigI",
"value": 2.9
},
{
"type": "Completeness",
"value": 87.3
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.956
}
]
}
]
}