Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3d76097408d13d5b75598c37637a0f2b",
"space_group_name": "P 3 2 1",
"unit_cell": {
"a": 169.739,
"b": 169.739,
"c": 39.707,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97779],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [19.670,2.000],
"number_observations": 381505,
"number_observations_unique": 44232,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 22.600
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 8.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.060,2.000],
"number_observations": 29916,
"number_observations_unique": 3606,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.559
},
{
"type": "I/SigI",
"value": 4.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 8.300
},
{
"type": "CC(1/2)",
"value": 0.928
}
]
},
{
"resolution_limits": [19.670,8.490],
"number_observations": 4499,
"number_observations_unique": 571,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 58.500
},
{
"type": "Completeness",
"value": 91.500
},
{
"type": "Redundancy",
"value": 7.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}