Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5465f96a7a58eb2a13bbaa066b0ca213",
"space_group_name": "P 61",
"unit_cell": {
"a": 110.140,
"b": 110.140,
"c": 114.231,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97852],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.610,2.300],
"number_observations": 659690,
"number_observations_unique": 34962,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.111
},
{
"type": "R(meas)",
"value": 0.114
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 13.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 18.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.380,2.300],
"number_observations_unique": 3389,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.067
},
{
"type": "R(meas)",
"value": 2.125
},
{
"type": "R(pim)",
"value": 0.490
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 18.600
},
{
"type": "CC(1/2)",
"value": 0.555
}
]
},
{
"resolution_limits": [49.610,8.910],
"number_observations_unique": 634,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(meas)",
"value": 0.029
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 16.200
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}