Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e4e665d8eeaf0a28a36c0c8f2e90b677",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 85.92,
"b": 56.73,
"c": 32.42,
"alpha": 90.00,
"beta": 94.69,
"gamma": 90.00
},
"wavelengths": [0.94055],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [32.31,1.39],
"number_observations": 214327,
"number_observations_unique": 30751,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "R(meas)",
"value": 0.082
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 12.0
},
{
"type": "Completeness",
"value": 98.5
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.43,1.39],
"number_observations": 14919,
"number_observations_unique": 2200,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.469
},
{
"type": "R(meas)",
"value": 2.672
},
{
"type": "R(pim)",
"value": 1.010
},
{
"type": "I/SigI",
"value": 0.8
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.322
}
]
}
]
}