Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c57474bc5dcc92356573a840b8826fdf",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 100.674,
"b": 143.452,
"c": 172.741,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.390,2.400],
"number_observations_unique": 98344,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.284
},
{
"type": "R(meas)",
"value": 0.294
},
{
"type": "R(pim)",
"value": 0.076
},
{
"type": "I/SigI",
"value": 11.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.800
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.440,2.400],
"number_observations_unique": 4785,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.150
},
{
"type": "R(meas)",
"value": 3.269
},
{
"type": "R(pim)",
"value": 0.866
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 14.000
},
{
"type": "CC(1/2)",
"value": 0.348
}
]
},
{
"resolution_limits": [48.390,13.150],
"number_observations_unique": 689,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 11.800
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}