Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4f841eeb92de164605f071dafe31c15c",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 46.49,
"b": 71.29,
"c": 79.07,
"alpha": 90.0,
"beta": 95.2,
"gamma": 90.0
},
"wavelengths": [0.97933],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.37,1.66],
"number_observations_unique": 59928,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 12.5
},
{
"type": "Completeness",
"value": 98.6
},
{
"type": "Redundancy",
"value": 4.2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.70,1.66],
"number_observations_unique": 4353,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.415
},
{
"type": "R(pim)",
"value": 0.789
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "CC(1/2)",
"value": 0.532
}
]
}
]
}