Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "854e4354c41cca6a0b730b304a22af7a",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 60.45,
"b": 79.56,
"c": 81.83,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97907],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.62,1.97],
"number_observations": 362205,
"number_observations_unique": 28598,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.156
},
{
"type": "R(meas)",
"value": 0.163
},
{
"type": "R(pim)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 12.6
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 12.7
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.02,1.97],
"number_observations": 27776,
"number_observations_unique": 2098,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.477
},
{
"type": "R(meas)",
"value": 1.535
},
{
"type": "R(pim)",
"value": 0.417
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "Redundancy",
"value": 13.2
},
{
"type": "CC(1/2)",
"value": 0.773
}
]
}
]
}