Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d0542361c1b90fc809994c35245eec7b",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 46.32,
"b": 127.91,
"c": 156.46,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [19.930,2.550],
"number_observations_unique": 30835,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "I/SigI",
"value": 8.900
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 3.590
}
]
},
"refln_shells": [
{
"resolution_limits": [2.64,2.55],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.270
},
{
"type": "I/SigI",
"value": 3.6
},
{
"type": "Completeness",
"value": 99.20
},
{
"type": "Redundancy",
"value": 3.68
}
]
},
{
"resolution_limits": [2.75,2.64],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.235
},
{
"type": "I/SigI",
"value": 3.8
},
{
"type": "Completeness",
"value": 99.30
},
{
"type": "Redundancy",
"value": 3.65
}
]
},
{
"resolution_limits": [2.87,2.75],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.193
},
{
"type": "I/SigI",
"value": 4.5
},
{
"type": "Completeness",
"value": 99.30
},
{
"type": "Redundancy",
"value": 3.66
}
]
},
{
"resolution_limits": [3.02,2.87],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.151
},
{
"type": "I/SigI",
"value": 5.8
},
{
"type": "Completeness",
"value": 99.10
},
{
"type": "Redundancy",
"value": 3.66
}
]
},
{
"resolution_limits": [3.21,3.02],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.119
},
{
"type": "I/SigI",
"value": 7.1
},
{
"type": "Completeness",
"value": 99.10
},
{
"type": "Redundancy",
"value": 3.60
}
]
},
{
"resolution_limits": [3.46,3.21],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.091
},
{
"type": "I/SigI",
"value": 9.0
},
{
"type": "Completeness",
"value": 98.80
},
{
"type": "Redundancy",
"value": 3.61
}
]
},
{
"resolution_limits": [3.80,3.46],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 10.8
},
{
"type": "Completeness",
"value": 98.80
},
{
"type": "Redundancy",
"value": 3.59
}
]
},
{
"resolution_limits": [4.35,3.80],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "I/SigI",
"value": 13.1
},
{
"type": "Completeness",
"value": 98.80
},
{
"type": "Redundancy",
"value": 3.50
}
]
},
{
"resolution_limits": [5.46,4.35],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 15.7
},
{
"type": "Completeness",
"value": 98.30
},
{
"type": "Redundancy",
"value": 3.51
}
]
},
{
"resolution_limits": [19.93,5.46],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 15.0
},
{
"type": "Completeness",
"value": 99.10
},
{
"type": "Redundancy",
"value": 3.50
}
]
}
]
}