Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a2f3f46618021f905a5382b6d8faaf30",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 99.345,
"b": 91.317,
"c": 51.374,
"alpha": 90.00,
"beta": 93.01,
"gamma": 90.00
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [51.3000,1.79],
"number_observations_unique": 42718,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.407
},
{
"type": "I/SigI",
"value": 84.880
},
{
"type": "Completeness",
"value": 99.480
},
{
"type": "Redundancy",
"value": 8.440
}
]
},
"refln_shells": [
{
"resolution_limits": [1.862,1.79],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.736
}
]
},
{
"resolution_limits": [1.937,1.862],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.667
}
]
},
{
"resolution_limits": [2.025,1.937],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.570
}
]
},
{
"resolution_limits": [2.132,2.025],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.507
}
]
},
{
"resolution_limits": [2.265,2.132],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.467
}
]
},
{
"resolution_limits": [2.440,2.265],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.454
}
]
},
{
"resolution_limits": [2.686,2.440],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.428
}
]
},
{
"resolution_limits": [3.074,2.686],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.411
}
]
},
{
"resolution_limits": [3.873,3.074],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.400
}
]
}
]
}