Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1fd31a2dc52e4484472105a87e889f54",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 115.261,
"b": 105.201,
"c": 105.814,
"alpha": 90.00,
"beta": 122.71,
"gamma": 90.00
},
"wavelengths": [0.99990],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.0,1.73],
"number_observations_unique": 107503,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "R(meas)",
"value": 0.088
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 17.23
},
{
"type": "Completeness",
"value": 97.5
},
{
"type": "Redundancy",
"value": 4.7
}
]
},
"refln_shells": [
{
"resolution_limits": [1.76,1.73],
"number_observations_unique": 5058,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.294
},
{
"type": "R(meas)",
"value": 0.347
},
{
"type": "R(pim)",
"value": 0.180
},
{
"type": "I/SigI",
"value": 2.63
},
{
"type": "Completeness",
"value": 92.1
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.785
}
]
}
]
}