Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e1bf4f5547043a231e8c11836dbab4dc",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 48.861,
"b": 106.478,
"c": 120.719,
"alpha": 90.00,
"beta": 90.35,
"gamma": 90.00
},
"wavelengths": [0.97872],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [100,2.6],
"number_observations_unique": 35626,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.134
},
{
"type": "I/SigI",
"value": 12.0
},
{
"type": "Completeness",
"value": 93.8
},
{
"type": "Redundancy",
"value": 2.7
}
]
},
"refln_shells": [
{
"resolution_limits": [2.69,2.6],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.399
},
{
"type": "I/SigI",
"value": 3.1
},
{
"type": "Completeness",
"value": 94.2
},
{
"type": "Redundancy",
"value": 2.3
}
]
},
{
"resolution_limits": [2.80,2.69],
"quality_factors": [
{
"type": "Completeness",
"value": 95.4
}
]
},
{
"resolution_limits": [2.93,2.80],
"quality_factors": [
{
"type": "Completeness",
"value": 96.8
}
]
},
{
"resolution_limits": [3.08,2.93],
"quality_factors": [
{
"type": "Completeness",
"value": 96.4
}
]
},
{
"resolution_limits": [3.28,3.08],
"quality_factors": [
{
"type": "Completeness",
"value": 95.5
}
]
},
{
"resolution_limits": [3.53,3.28],
"quality_factors": [
{
"type": "Completeness",
"value": 94
}
]
},
{
"resolution_limits": [3.88,3.53],
"quality_factors": [
{
"type": "Completeness",
"value": 93
}
]
},
{
"resolution_limits": [4.45,3.88],
"quality_factors": [
{
"type": "Completeness",
"value": 91.8
}
]
},
{
"resolution_limits": [5.60,4.45],
"quality_factors": [
{
"type": "Completeness",
"value": 91.2
}
]
},
{
"resolution_limits": [100,5.60],
"quality_factors": [
{
"type": "Completeness",
"value": 89.8
}
]
}
]
}