Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e9655aadda245e1528a9fd7eccbe8518",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 55.255,
"b": 98.372,
"c": 58.765,
"alpha": 90.00,
"beta": 107.87,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.190,1.650],
"number_observations": 247291,
"number_observations_unique": 71150,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 10.700
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.680,1.650],
"number_observations": 13113,
"number_observations_unique": 3668,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.704
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.756
}
]
},
{
"resolution_limits": [49.190,8.890],
"number_observations": 1677,
"number_observations_unique": 487,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 30.400
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}