Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "b1d57042022baa5669530054f39f5cb3",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.751,
"b": 88.751,
"c": 39.361,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.88557],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.380,1.010],
"number_observations": 1033985,
"number_observations_unique": 160391,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 15.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.030,1.010],
"number_observations": 40708,
"number_observations_unique": 7781,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.110
},
{
"type": "R(meas)",
"value": 3.455
},
{
"type": "R(pim)",
"value": 1.467
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 5.200
},
{
"type": "CC(1/2)",
"value": 0.441
}
]
},
{
"resolution_limits": [44.380,5.530],
"number_observations": 7225,
"number_observations_unique": 1065,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "R(meas)",
"value": 0.033
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 66.500
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}