Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1775444f5b9e0b8adbd71c9b9a6c64e1",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 67.945,
"b": 120.303,
"c": 127.818,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.03320],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.6,3.39],
"number_observations_unique": 15118,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "I/SigI",
"value": 9.1
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 8.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [3.670,3.400],
"number_observations_unique": 3053,
"quality_factors": [
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.128
}
]
},
{
"resolution_limits": [46.740,9.000],
"number_observations_unique": 905,
"quality_factors": [
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}