Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dea07d39190b0679657c3c6868689078",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 45.336,
"b": 54.230,
"c": 113.069,
"alpha": 90.00,
"beta": 100.66,
"gamma": 90.00
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.56,2.10],
"number_observations_unique": 15885,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.110
},
{
"type": "I/SigI",
"value": 10.37
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 4.4
},
{
"type": "CC(1/2)",
"value": 0.981
}
]
},
"refln_shells": [
{
"resolution_limits": [2.18,2.10],
"number_observations_unique": 1591,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.747
},
{
"type": "I/SigI",
"value": 0.95
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 4.6
},
{
"type": "CC(1/2)",
"value": 0.464
}
]
}
]
}