Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "444d5a9e9fc296c9d0ef31d46858f116",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 43.947,
"b": 80.528,
"c": 60.918,
"alpha": 90.00,
"beta": 100.69,
"gamma": 90.00
},
"wavelengths": [0.87313],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.09,1.45],
"number_observations_unique": 72942,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.096
},
{
"type": "R(meas)",
"value": 0.104
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 10.0
},
{
"type": "Completeness",
"value": 99.0
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.47,1.45],
"number_observations": 24050,
"number_observations_unique": 3580,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.995
},
{
"type": "R(meas)",
"value": 2.164
},
{
"type": "R(pim)",
"value": 0.822
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.455
}
]
}
]
}