Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8a59538e63c5db12939412fe3562ceb0",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 55.093,
"b": 98.550,
"c": 59.007,
"alpha": 90.0,
"beta": 108.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.770,1.650],
"number_observations": 733433,
"number_observations_unique": 71947,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.139
},
{
"type": "I/SigI",
"value": 8.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.200
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.680,1.650],
"number_observations": 34848,
"number_observations_unique": 3569,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.381
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 9.800
},
{
"type": "CC(1/2)",
"value": 0.777
}
]
},
{
"resolution_limits": [48.770,9.040],
"number_observations": 4698,
"number_observations_unique": 463,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "I/SigI",
"value": 22.400
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 10.100
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}