Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "20d8294f048869a0224c08362b6d12f0",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 127.394,
"b": 84.763,
"c": 88.190,
"alpha": 90.00,
"beta": 130.99,
"gamma": 90.00
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [66.650,1.300],
"number_observations_unique": 126742,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "I/SigI",
"value": 17.800
},
{
"type": "Completeness",
"value": 73.700
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.330,1.300],
"number_observations_unique": 400,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.780
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 4.700
},
{
"type": "CC(1/2)",
"value": 0.390
}
]
},
{
"resolution_limits": [66.650,3.540],
"number_observations_unique": 8761,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 57.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}