Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f7acd9f5bde428a6c48343c1412fb689",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 100.28,
"b": 91.56,
"c": 51.65,
"alpha": 90.00,
"beta": 111.88,
"gamma": 90.00
},
"wavelengths": [0.97626],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.930,1.910],
"number_observations_unique": 33162,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.094
},
{
"type": "I/SigI",
"value": 7.800
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [1.980,1.910],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.624
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Completeness",
"value": 92.500
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.672
}
]
},
{
"resolution_limits": [47.930,7.400],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "I/SigI",
"value": 16.8
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
}
]
}