Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3727d10c1d2921f24365aaa79a031e0f",
"space_group_name": "P 21 2 21",
"unit_cell": {
"a": 42.602,
"b": 64.509,
"c": 85.919,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.96,1.75],
"number_observations_unique": 24607,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 17.3
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 7.7
},
{
"type": "CC(1/2)",
"value": 1.00
}
]
},
"refln_shells": [
{
"resolution_limits": [1.84,1.75],
"number_observations_unique": 3541,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.55
},
{
"type": "R(pim)",
"value": 0.59
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "CC(1/2)",
"value": 0.73
}
]
}
]
}