Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "15575cdb5f5d1e711f8c54fb57df51b6",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 149.052,
"b": 114.730,
"c": 63.800,
"alpha": 90.00,
"beta": 109.43,
"gamma": 90.00
},
"wavelengths": [0.92819],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [70.28,2.10],
"number_observations_unique": 58838,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.103
},
{
"type": "R(meas)",
"value": 0.125
},
{
"type": "R(pim)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 7.1
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [2.16,2.10],
"number_observations_unique": 4554,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.475
},
{
"type": "R(meas)",
"value": 0.589
},
{
"type": "R(pim)",
"value": 0.343
},
{
"type": "I/SigI",
"value": 2.3
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 2.8
},
{
"type": "CC(1/2)",
"value": 0.603
}
]
}
]
}