Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "eddbc51347e1e9298a9cb2d5e61a71ca",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 81.73,
"b": 81.73,
"c": 135.18,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [34.240,2.050],
"number_observations": 660983,
"number_observations_unique": 33462,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.113
},
{
"type": "R(meas)",
"value": 0.116
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 19.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.800
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.100,2.050],
"number_observations": 49641,
"number_observations_unique": 2423,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.953
},
{
"type": "R(meas)",
"value": 2.003
},
{
"type": "R(pim)",
"value": 0.440
},
{
"type": "I/SigI",
"value": 2.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.500
},
{
"type": "CC(1/2)",
"value": 0.771
}
]
},
{
"resolution_limits": [34.240,9.170],
"number_observations": 6394,
"number_observations_unique": 434,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 53.700
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 14.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}