Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f4d47937fb43c89c49b56c2c03c81bcf",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.284,
"b": 41.429,
"c": 72.214,
"alpha": 90.0,
"beta": 104.5,
"gamma": 90.0
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.429,1.08],
"number_observations_unique": 102490,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 14.53
},
{
"type": "Completeness",
"value": 98.6
},
{
"type": "Redundancy",
"value": 3.60
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.15,1.08],
"number_observations_unique": 15912,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.24
},
{
"type": "I/SigI",
"value": 4.09
},
{
"type": "Completeness",
"value": 95.1
},
{
"type": "Redundancy",
"value": 3.57
},
{
"type": "CC(1/2)",
"value": 0.942
}
]
}
]
}