Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f183519c007b7a8fb5bffd3fa72df6ff",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 66.107,
"b": 39.394,
"c": 61.454,
"alpha": 90.00,
"beta": 108.56,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.350,1.150],
"number_observations": 172310,
"number_observations_unique": 52941,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 12.000
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 3.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.170,1.150],
"number_observations_unique": 2610,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.837
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.720
}
]
},
{
"resolution_limits": [33.350,6.300],
"number_observations_unique": 343,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}