Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d5f935a3269f56b2725d2f34344a4d2d",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.924,
"b": 53.584,
"c": 44.313,
"alpha": 90.00,
"beta": 100.82,
"gamma": 90.00
},
"wavelengths": [0.91261],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.95,1.49],
"number_observations": 131387,
"number_observations_unique": 42770,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.096
},
{
"type": "R(meas)",
"value": 0.116
},
{
"type": "R(pim)",
"value": 0.064
},
{
"type": "I/SigI",
"value": 9.0
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.52,1.49],
"number_observations": 4950,
"number_observations_unique": 2049,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.014
},
{
"type": "R(meas)",
"value": 1.302
},
{
"type": "R(pim)",
"value": 0.805
},
{
"type": "I/SigI",
"value": 1.0
},
{
"type": "Redundancy",
"value": 2.4
},
{
"type": "CC(1/2)",
"value": 0.344
}
]
}
]
}