Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "bba1cedd94dd11499068f382c262236c",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 57.776,
"b": 57.776,
"c": 150.111,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97633],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.783,1.500],
"number_observations_unique": 11936,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 41.8
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 14.1
}
]
},
"refln_shells": [
{
"resolution_limits": [1.580,1.500],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.099
},
{
"type": "I/SigI",
"value": 7.40
},
{
"type": "Completeness",
"value": 98.4
},
{
"type": "Redundancy",
"value": 14.7
}
]
},
{
"resolution_limits": [1.680,1.580],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "I/SigI",
"value": 9.00
},
{
"type": "Completeness",
"value": 98.7
},
{
"type": "Redundancy",
"value": 13.9
}
]
},
{
"resolution_limits": [1.790,1.680],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "I/SigI",
"value": 10.50
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 14.9
}
]
},
{
"resolution_limits": [1.940,1.790],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "I/SigI",
"value": 11.90
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 14.6
}
]
},
{
"resolution_limits": [2.120,1.940],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 13.10
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 13.5
}
]
},
{
"resolution_limits": [2.370,2.120],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 14.20
},
{
"type": "Completeness",
"value": 99.6
},
{
"type": "Redundancy",
"value": 14.7
}
]
},
{
"resolution_limits": [2.740,2.370],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 14.50
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 14.1
}
]
},
{
"resolution_limits": [3.350,2.740],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 13.90
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 13.1
}
]
},
{
"resolution_limits": [4.740,3.350],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 12.90
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 13.5
}
]
},
{
"resolution_limits": [45.783,4.740],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 12.00
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 11.9
}
]
}
]
}