Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f8e296b99eeb8e726f69e10ca36fc81f",
"space_group_name": "I 21 21 21",
"unit_cell": {
"a": 125.68,
"b": 122.08,
"c": 159.62,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.5,2.350],
"number_observations_unique": 51368,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "I/SigI",
"value": 17.720
},
{
"type": "Completeness",
"value": 100.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.450,2.350],
"number_observations": 44915,
"number_observations_unique": 5963,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.584
},
{
"type": "I/SigI",
"value": 4.430
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [10.000,2.450],
"number_observations": 332200,
"number_observations_unique": 44661,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.091
},
{
"type": "I/SigI",
"value": 19.100
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [49.5,10.000],
"number_observations": 4799,
"number_observations_unique": 744,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 41.380
},
{
"type": "Completeness",
"value": 98.700
}
]
}
]
}