Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2ba0b1e09ed48f84f44d8f2ccc946969",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.022,
"b": 66.804,
"c": 103.120,
"alpha": 90.000,
"beta": 94.386,
"gamma": 90.000
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.89,2.43],
"number_observations_unique": 22678,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.1232
},
{
"type": "I/SigI",
"value": 19.97
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 17.66
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.53,2.43],
"number_observations_unique": 2531,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.4421
},
{
"type": "I/SigI",
"value": 5.11
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 11.4
},
{
"type": "CC(1/2)",
"value": 0.948
}
]
}
]
}