Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0a76c06c37a3240e3863001ae7df2bb8",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 55.042,
"b": 98.604,
"c": 58.349,
"alpha": 90.00,
"beta": 107.62,
"gamma": 90.00
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.31,1.85],
"number_observations": 780788,
"number_observations_unique": 50633,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "R(meas)",
"value": 0.109
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 19.0
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 15.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.89,1.85],
"number_observations": 29804,
"number_observations_unique": 3133,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.645
},
{
"type": "R(meas)",
"value": 1.739
},
{
"type": "R(pim)",
"value": 0.561
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Redundancy",
"value": 9.5
},
{
"type": "CC(1/2)",
"value": 0.764
}
]
}
]
}