Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b9946998f5e6248de1afb9917fc256dc",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.806,
"b": 88.806,
"c": 39.518,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.400,1.000],
"number_observations": 1053476,
"number_observations_unique": 165516,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "R(meas)",
"value": 0.049
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 15.100
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.020,1.000],
"number_observations": 33755,
"number_observations_unique": 7519,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.062
},
{
"type": "R(meas)",
"value": 1.200
},
{
"type": "R(pim)",
"value": 0.545
},
{
"type": "I/SigI",
"value": 0.900
},
{
"type": "Completeness",
"value": 91.500
},
{
"type": "Redundancy",
"value": 4.500
},
{
"type": "CC(1/2)",
"value": 0.697
}
]
},
{
"resolution_limits": [44.400,5.480],
"number_observations": 7501,
"number_observations_unique": 1096,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(meas)",
"value": 0.029
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 52.500
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}