Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "cd7169732f6422ccf5f9494fbb23b27a",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 55.24,
"b": 107.56,
"c": 55.56,
"alpha": 90.00,
"beta": 90.84,
"gamma": 90.00
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.55,1.63],
"number_observations_unique": 79745,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 9.9
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 2.6
},
{
"type": "CC(1/2)",
"value": 0.978
}
]
},
"refln_shells": [
{
"resolution_limits": [1.66,1.63],
"number_observations_unique": 3899,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.345
},
{
"type": "I/SigI",
"value": 2.9
},
{
"type": "Completeness",
"value": 98.2
},
{
"type": "CC(1/2)",
"value": 0.752
}
]
}
]
}