Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "353d8220443cc420909152c821f75a12",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 54.857,
"b": 98.497,
"c": 58.682,
"alpha": 90.00,
"beta": 107.65,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.630,1.650],
"number_observations": 254941,
"number_observations_unique": 70053,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 11.500
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.680,1.650],
"number_observations": 13155,
"number_observations_unique": 3481,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.626
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 3.800
},
{
"type": "CC(1/2)",
"value": 0.802
}
]
},
{
"resolution_limits": [48.630,9.040],
"number_observations": 1582,
"number_observations_unique": 433,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 38.000
},
{
"type": "Completeness",
"value": 94.400
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}