Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4120fa3a2ea9511b8ec4152b863b4c14",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 47.473,
"b": 171.422,
"c": 50.478,
"alpha": 90.0,
"beta": 117.6,
"gamma": 90.0
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.86,1.55],
"number_observations_unique": 102393,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.05
},
{
"type": "R(meas)",
"value": 0.05
},
{
"type": "R(pim)",
"value": 0.02
},
{
"type": "I/SigI",
"value": 25.71
},
{
"type": "Completeness",
"value": 99.28
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.605,1.55],
"number_observations_unique": 9786,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.17
},
{
"type": "R(meas)",
"value": 0.19
},
{
"type": "R(pim)",
"value": 0.080
},
{
"type": "I/SigI",
"value": 7.66
},
{
"type": "Completeness",
"value": 95.09
},
{
"type": "Redundancy",
"value": 5.5
},
{
"type": "CC(1/2)",
"value": 0.98
}
]
}
]
}