Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "5723fc72abc787b48e01e4986df785f8",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 81.59,
"b": 81.59,
"c": 135.27,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [35.330,1.930],
"number_observations": 798158,
"number_observations_unique": 39886,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "R(meas)",
"value": 0.083
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 24.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.980,1.930],
"number_observations": 60109,
"number_observations_unique": 2911,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.855
},
{
"type": "R(meas)",
"value": 1.902
},
{
"type": "R(pim)",
"value": 0.417
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.600
},
{
"type": "CC(1/2)",
"value": 0.796
}
]
},
{
"resolution_limits": [35.330,8.630],
"number_observations": 7918,
"number_observations_unique": 518,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(meas)",
"value": 0.028
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 71.000
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 15.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}