Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f943f8ba613859726d07ae121a547f93",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 47.87,
"b": 77.96,
"c": 84.68,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.870,1.840],
"number_observations": 368922,
"number_observations_unique": 28234,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.145
},
{
"type": "R(meas)",
"value": 0.152
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 15.900
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 13.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.890,1.840],
"number_observations": 26775,
"number_observations_unique": 2043,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.753
},
{
"type": "R(meas)",
"value": 1.824
},
{
"type": "R(pim)",
"value": 0.502
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 13.100
},
{
"type": "CC(1/2)",
"value": 0.670
}
]
},
{
"resolution_limits": [47.870,8.230],
"number_observations": 4162,
"number_observations_unique": 380,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.038
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 49.400
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 11.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}