Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "be37ea1eec294eb22b98129c94a97eee",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 56.93,
"b": 107.16,
"c": 99.76,
"alpha": 90.00,
"beta": 100.68,
"gamma": 90.00
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.12,2.01],
"number_observations_unique": 78225,
"quality_factors": [
{
"type": "I/SigI",
"value": 7.0
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 7.4
}
]
},
"refln_shells": [
{
"resolution_limits": [2.050,2.010],
"number_observations": 31465,
"number_observations_unique": 4437,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.198
},
{
"type": "R(pim)",
"value": 0.484
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 7.100
},
{
"type": "CC(1/2)",
"value": 0.621
}
]
},
{
"resolution_limits": [45.120,10.250],
"number_observations": 4499,
"number_observations_unique": 621,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 17.800
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 7.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}