Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "e99652806846c9c15e0f59dfdb4581ca",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 61.532,
"b": 99.687,
"c": 61.762,
"alpha": 90.000,
"beta": 103.191,
"gamma": 90.000
},
"wavelengths": [1.03320],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [99.69,1.85],
"number_observations_unique": 357749,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 16.5
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 5.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.89,1.85],
"number_observations_unique": 22900,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.692
},
{
"type": "R(meas)",
"value": 0.835
},
{
"type": "R(pim)",
"value": 0.463
},
{
"type": "CC(1/2)",
"value": 0.745
}
]
}
]
}