Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e16aa129d19d120cf509b43bcbad9d04",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 115.65,
"b": 115.65,
"c": 186.69,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.12713],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.320,1.790],
"number_observations_unique": 136181,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 13.7
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 9.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.840,1.790],
"number_observations_unique": 9979,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.487
},
{
"type": "R(pim)",
"value": 0.833
},
{
"type": "I/SigI",
"value": 0.9
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 9.800
},
{
"type": "CC(1/2)",
"value": 0.344
}
]
},
{
"resolution_limits": [36.320,8.010],
"number_observations_unique": 1687,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.035
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 41.8
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 9.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}