Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e41d6d597f35c72427c667276eb28952",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 88.696,
"b": 29.096,
"c": 83.946,
"alpha": 90.00,
"beta": 114.16,
"gamma": 90.00
},
"wavelengths": [0.96598],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.310,1.850],
"number_observations_unique": 15362,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "I/SigI",
"value": 7.700
},
{
"type": "Completeness",
"value": 89.8
},
{
"type": "Redundancy",
"value": 2.600
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [1.890,1.850],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.414
},
{
"type": "Completeness",
"value": 87.8
},
{
"type": "Redundancy",
"value": 2.5
},
{
"type": "CC(1/2)",
"value": 0.740
}
]
},
{
"resolution_limits": [38.310,8.920],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "Completeness",
"value": 91.800
},
{
"type": "Redundancy",
"value": 2.800
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}