Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "50b1b2275dcbe28c213eee2a4126d0f8",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 76.694,
"b": 119.545,
"c": 141.639,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96546],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [70.820,1.782],
"number_observations_unique": 101703,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.093
},
{
"type": "R(meas)",
"value": 0.097
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 15.4
},
{
"type": "Completeness",
"value": 96.3
},
{
"type": "Redundancy",
"value": 13.2
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.917,1.782],
"number_observations_unique": 5085,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.548
},
{
"type": "R(meas)",
"value": 1.615
},
{
"type": "R(pim)",
"value": 0.455
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 66.7
},
{
"type": "Redundancy",
"value": 12.4
},
{
"type": "CC(1/2)",
"value": 0.643
}
]
}
]
}