Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "98062cb4c60d7af13c3b0d05139c5d3e",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 114.994,
"b": 50.112,
"c": 41.887,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97945],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [19.679,1.058],
"number_observations_unique": 111095,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "I/SigI",
"value": 33.6
},
{
"type": "Completeness",
"value": 96.4
},
{
"type": "Redundancy",
"value": 2.2
}
]
},
"refln_shells": [
{
"resolution_limits": [1.08,1.058],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.592
},
{
"type": "I/SigI",
"value": 2.1
},
{
"type": "Completeness",
"value": 83.6
},
{
"type": "Redundancy",
"value": 4.8
}
]
},
{
"resolution_limits": [1.10,1.08],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.517
},
{
"type": "I/SigI",
"value": 2.6
},
{
"type": "Completeness",
"value": 89.5
},
{
"type": "Redundancy",
"value": 4.5
}
]
},
{
"resolution_limits": [1.12,1.10],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.458
},
{
"type": "I/SigI",
"value": 3.3
},
{
"type": "Completeness",
"value": 94.5
},
{
"type": "Redundancy",
"value": 4.2
}
]
}
]
}