Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "deb28b98e40e3a648dbc896ff97c8fdb",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.166,
"b": 41.445,
"c": 72.097,
"alpha": 90.00,
"beta": 104.48,
"gamma": 90.00
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.445,1.089],
"number_observations_unique": 96745,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 20.88
},
{
"type": "Completeness",
"value": 95.9
},
{
"type": "Redundancy",
"value": 3.69
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.16,1.09],
"number_observations_unique": 14752,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.098
},
{
"type": "I/SigI",
"value": 9.31
},
{
"type": "Completeness",
"value": 91.0
},
{
"type": "Redundancy",
"value": 3.82
},
{
"type": "CC(1/2)",
"value": 0.99
}
]
}
]
}