Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "3e674153046c9ba6a4b43b39fa79331f",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 66.165,
"b": 49.202,
"c": 85.294,
"alpha": 90.000,
"beta": 99.158,
"gamma": 90.000
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.043,1.969],
"number_observations_unique": 21339,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "R(meas)",
"value": 0.088
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 11.3
},
{
"type": "Completeness",
"value": 90.9
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.230,1.969],
"number_observations_unique": 1068,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.446
},
{
"type": "R(meas)",
"value": 1.590
},
{
"type": "R(pim)",
"value": 0.648
},
{
"type": "I/SigI",
"value": 1.2
},
{
"type": "Completeness",
"value": 66.4
},
{
"type": "Redundancy",
"value": 5.8
},
{
"type": "CC(1/2)",
"value": 0.484
}
]
}
]
}