Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dec340724a4ee38a2b50211a61aa41e8",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 129.50,
"b": 129.50,
"c": 137.83,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97910],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [64.750,2.340],
"number_observations": 590046,
"number_observations_unique": 56185,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.099
},
{
"type": "R(meas)",
"value": 0.104
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 15.400
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 10.500
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.410,2.340],
"number_observations": 47040,
"number_observations_unique": 4533,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.929
},
{
"type": "R(meas)",
"value": 0.977
},
{
"type": "R(pim)",
"value": 0.300
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 10.400
},
{
"type": "CC(1/2)",
"value": 0.821
}
]
},
{
"resolution_limits": [64.750,9.930],
"number_observations": 7666,
"number_observations_unique": 822,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "R(meas)",
"value": 0.039
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 48.500
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 9.300
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}