Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7e4164e68f781f49f2673fbae9a2d982",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 58.369,
"b": 92.356,
"c": 105.309,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.68,1.20],
"number_observations": 2290949,
"number_observations_unique": 177793,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 17.1
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 12.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.22,1.20],
"number_observations": 85498,
"number_observations_unique": 8671,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.218
},
{
"type": "R(meas)",
"value": 2.339
},
{
"type": "R(pim)",
"value": 0.730
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Redundancy",
"value": 9.9
},
{
"type": "CC(1/2)",
"value": 0.467
}
]
}
]
}