Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "7ae8f1e22ef46e628294502cd045ee75",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 76.945,
"b": 168.234,
"c": 76.957,
"alpha": 90.00,
"beta": 93.65,
"gamma": 90.00
},
"wavelengths": [0.97000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.68,1.87],
"number_observations_unique": 78761,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "R(meas)",
"value": 0.077
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 14.3
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.91,1.87],
"number_observations_unique": 4100,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.752
},
{
"type": "R(meas)",
"value": 0.826
},
{
"type": "R(pim)",
"value": 0.335
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 90.3
},
{
"type": "Redundancy",
"value": 5.8
},
{
"type": "CC(1/2)",
"value": 0.803
}
]
}
]
}