Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8d74a569d51fc85f232a2586ebf99b88",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 231.513,
"b": 77.478,
"c": 116.039,
"alpha": 90.000,
"beta": 113.207,
"gamma": 90.000
},
"wavelengths": [1.54100],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30,2.589],
"number_observations_unique": 58719,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.194
},
{
"type": "R(pim)",
"value": 0.089
},
{
"type": "I/SigI",
"value": 7.3
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 7.3
},
{
"type": "CC(1/2)",
"value": 0.975
}
]
},
"refln_shells": [
{
"resolution_limits": [2.64,2.6],
"number_observations_unique": 2903,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.535
},
{
"type": "R(pim)",
"value": 0.351
},
{
"type": "CC(1/2)",
"value": 0.854
}
]
}
]
}