Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b0f7e69eb09bc9c32927c98c2a5c5d2d",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.538,
"b": 61.640,
"c": 65.306,
"alpha": 90.00,
"beta": 92.99,
"gamma": 90.00
},
"wavelengths": [0.92203],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [32.61,1.60],
"number_observations": 261179,
"number_observations_unique": 37072,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.240
},
{
"type": "R(meas)",
"value": 0.260
},
{
"type": "R(pim)",
"value": 0.099
},
{
"type": "I/SigI",
"value": 4.5
},
{
"type": "Completeness",
"value": 97.6
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.966
}
]
},
"refln_shells": [
{
"resolution_limits": [1.63,1.60],
"number_observations": 11787,
"number_observations_unique": 1790,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.431
},
{
"type": "R(meas)",
"value": 2.643
},
{
"type": "R(pim)",
"value": 1.023
},
{
"type": "I/SigI",
"value": 0.4
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 0.293
}
]
}
]
}