Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a9206b89ab8ce17910c72b0210ecd347",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 85.611,
"b": 57.009,
"c": 32.184,
"alpha": 90.00,
"beta": 95.07,
"gamma": 90.00
},
"wavelengths": [0.94055],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.40,1.49],
"number_observations": 172014,
"number_observations_unique": 24997,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.191
},
{
"type": "R(meas)",
"value": 0.206
},
{
"type": "R(pim)",
"value": 0.077
},
{
"type": "I/SigI",
"value": 4.0
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.52,1.49],
"number_observations": 8401,
"number_observations_unique": 1201,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.237
},
{
"type": "R(meas)",
"value": 3.493
},
{
"type": "R(pim)",
"value": 1.300
},
{
"type": "I/SigI",
"value": 0.2
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.514
}
]
}
]
}