Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b631a24259a007dd28f24e58d692b436",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 70.030,
"b": 125.358,
"c": 29.681,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [70.030,1.820],
"number_observations": 155044,
"number_observations_unique": 24239,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 19.900
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.100,1.820],
"number_observations": 53623,
"number_observations_unique": 8340,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.523
},
{
"type": "R(pim)",
"value": 0.222
},
{
"type": "I/SigI",
"value": 3.400
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.961
}
]
},
{
"resolution_limits": [70.030,3.640],
"number_observations": 19369,
"number_observations_unique": 3236,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 57.400
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}