Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "24804154def2d7ac6d6d4ccaf1b5eef1",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 48.01,
"b": 60.47,
"c": 65.38,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [32.590,1.710],
"number_observations": 135108,
"number_observations_unique": 21116,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.059
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 15.200
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.750,1.710],
"number_observations": 8607,
"number_observations_unique": 1516,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.291
},
{
"type": "R(meas)",
"value": 1.424
},
{
"type": "R(pim)",
"value": 0.591
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 5.700
},
{
"type": "CC(1/2)",
"value": 0.635
}
]
},
{
"resolution_limits": [32.590,7.650],
"number_observations": 1544,
"number_observations_unique": 285,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(meas)",
"value": 0.029
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 48.100
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 5.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}