Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f97bec5a28c113572daf0264b7bb5e5a",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 41.27,
"b": 74.56,
"c": 101.07,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.83,1.37],
"number_observations": 885861,
"number_observations_unique": 66337,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.122
},
{
"type": "R(meas)",
"value": 0.127
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 12.5
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 13.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.41,1.37],
"number_observations": 62522,
"number_observations_unique": 4804,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.699
},
{
"type": "R(meas)",
"value": 2.809
},
{
"type": "R(pim)",
"value": 0.768
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Redundancy",
"value": 13.0
},
{
"type": "CC(1/2)",
"value": 0.554
}
]
}
]
}