Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2088153dc7da69ff2258ab8ca4175add",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 54.588,
"b": 111.529,
"c": 67.695,
"alpha": 90.000,
"beta": 108.467,
"gamma": 90.000
},
"wavelengths": [0.97946],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.94,1.63],
"number_observations_unique": 93667,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "R(meas)",
"value": 0.077
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 12.8
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.67,1.63],
"number_observations_unique": 5126,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.665
},
{
"type": "R(meas)",
"value": 0.722
},
{
"type": "R(pim)",
"value": 0.276
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 97.9
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.948
}
]
}
]
}