Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b3dbab327f4b554b1c9db3ba275791d3",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 55.418,
"b": 99.032,
"c": 59.111,
"alpha": 90.0,
"beta": 108.2,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.850,1.600],
"number_observations": 269373,
"number_observations_unique": 79076,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "I/SigI",
"value": 11.500
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.630,1.600],
"number_observations": 13661,
"number_observations_unique": 3894,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.820
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.650
}
]
},
{
"resolution_limits": [48.850,8.760],
"number_observations": 1759,
"number_observations_unique": 502,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "I/SigI",
"value": 35.900
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.972
}
]
}
]
}