Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8cf9643e21d9281955bac30a9980bc18",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 35.292,
"b": 82.081,
"c": 41.581,
"alpha": 90.00,
"beta": 95.84,
"gamma": 90.00
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.0400,1.780],
"number_observations_unique": 22460,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.178
},
{
"type": "I/SigI",
"value": 271.079
},
{
"type": "Completeness",
"value": 97.680
},
{
"type": "Redundancy",
"value": 4.660
}
]
},
"refln_shells": [
{
"resolution_limits": [1.844,1.780],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.639
}
]
},
{
"resolution_limits": [1.918,1.844],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.541
}
]
},
{
"resolution_limits": [2.005,1.918],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.407
}
]
},
{
"resolution_limits": [2.111,2.005],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.273
}
]
},
{
"resolution_limits": [2.243,2.111],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.227
}
]
},
{
"resolution_limits": [2.416,2.243],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.216
}
]
},
{
"resolution_limits": [2.659,2.416],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.200
}
]
},
{
"resolution_limits": [3.044,2.659],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.181
}
]
},
{
"resolution_limits": [3.834,3.044],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.164
}
]
}
]
}