Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "722a9b8ce3e0362306de33c8ed67e5df",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 88.129,
"b": 57.266,
"c": 110.795,
"alpha": 90.00,
"beta": 95.67,
"gamma": 90.00
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [87.698,2.026],
"number_observations_unique": 71757,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 15.9
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 7.3
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.043,2.026],
"number_observations_unique": 1805,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.828
},
{
"type": "R(pim)",
"value": 0.339
},
{
"type": "I/SigI",
"value": 2.9
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.872
}
]
}
]
}