Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ac542635d12622bc5184135a3c8b759f",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 67.774,
"b": 68.054,
"c": 138.403,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91788],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [69.210,1.950],
"number_observations": 321369,
"number_observations_unique": 47501,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.231
},
{
"type": "R(meas)",
"value": 0.250
},
{
"type": "R(pim)",
"value": 0.096
},
{
"type": "I/SigI",
"value": 6.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.950
}
]
},
"refln_shells": [
{
"resolution_limits": [2.000,1.950],
"number_observations": 21181,
"number_observations_unique": 3298,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.403
},
{
"type": "R(meas)",
"value": 3.706
},
{
"type": "R(pim)",
"value": 1.451
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.299
}
]
},
{
"resolution_limits": [69.210,8.930],
"number_observations": 3262,
"number_observations_unique": 588,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 37.900
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.774
}
]
}
]
}