Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "18bd06f2ac4fa4b309f0f67ba6fe6ad7",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 70.91,
"b": 53.07,
"c": 106.75,
"alpha": 90.00,
"beta": 106.86,
"gamma": 90.00
},
"wavelengths": [1.60500],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [104.828,3.056],
"number_observations_unique": 11987,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.111
},
{
"type": "I/SigI",
"value": 7.01
},
{
"type": "Completeness",
"value": 97.1
},
{
"type": "Redundancy",
"value": 3.7
}
]
},
"refln_shells": [
{
"resolution_limits": [3.22,3.056],
"quality_factors": [
{
"type": "R(merge)",
"value": 1.02
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "Completeness",
"value": 98.5
}
]
},
{
"resolution_limits": [3.31,3.22],
"quality_factors": [
{
"type": "Completeness",
"value": 97
}
]
},
{
"resolution_limits": [3.41,3.31],
"quality_factors": [
{
"type": "Completeness",
"value": 96.2
}
]
},
{
"resolution_limits": [3.52,3.41],
"quality_factors": [
{
"type": "Completeness",
"value": 95.1
}
]
},
{
"resolution_limits": [3.65,3.52],
"quality_factors": [
{
"type": "Completeness",
"value": 97.9
}
]
},
{
"resolution_limits": [50.0,3.65],
"quality_factors": [
{
"type": "Completeness",
"value": 96.5
}
]
}
]
}