Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ae26832d0b846d3cdb9164524f982b39",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 55.066,
"b": 98.602,
"c": 58.983,
"alpha": 90.00,
"beta": 107.93,
"gamma": 90.00
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.27,1.65],
"number_observations": 1065514,
"number_observations_unique": 71989,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "R(meas)",
"value": 0.066
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 30.6
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 14.8
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.68,1.65],
"number_observations": 31335,
"number_observations_unique": 3567,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.212
},
{
"type": "R(meas)",
"value": 1.287
},
{
"type": "R(pim)",
"value": 0.430
},
{
"type": "I/SigI",
"value": 1.9
},
{
"type": "Redundancy",
"value": 8.8
},
{
"type": "CC(1/2)",
"value": 0.706
}
]
}
]
}