Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b00340240eda17a21146f5fd75726aac",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.801,
"b": 88.801,
"c": 39.735,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.400,0.990],
"number_observations": 1107449,
"number_observations_unique": 171053,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "R(meas)",
"value": 0.054
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 14.500
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.010,0.990],
"number_observations": 37802,
"number_observations_unique": 7691,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.179
},
{
"type": "R(meas)",
"value": 2.438
},
{
"type": "R(pim)",
"value": 1.069
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 91.300
},
{
"type": "Redundancy",
"value": 4.900
},
{
"type": "CC(1/2)",
"value": 0.426
}
]
},
{
"resolution_limits": [44.400,5.420],
"number_observations": 7970,
"number_observations_unique": 1132,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(meas)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 61.300
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 7.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}