Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e9b7966c3e016ea24780af09e3f2a901",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 104.483,
"b": 104.483,
"c": 128.238,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.1,2.60],
"number_observations_unique": 25285,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.179
},
{
"type": "I/SigI",
"value": 19.3
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 15.1
}
]
},
"refln_shells": [
{
"resolution_limits": [2.690,2.600],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.909
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.590
}
]
},
{
"resolution_limits": [2.800,2.690],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.731
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.660
}
]
},
{
"resolution_limits": [2.930,2.800],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.577
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.748
}
]
},
{
"resolution_limits": [3.080,2.930],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.452
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.828
}
]
},
{
"resolution_limits": [3.280,3.080],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.354
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.858
}
]
},
{
"resolution_limits": [3.530,3.280],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.270
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.902
}
]
},
{
"resolution_limits": [3.880,3.530],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.224
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.936
}
]
},
{
"resolution_limits": [4.450,3.880],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.200
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.400
},
{
"type": "CC(1/2)",
"value": 0.956
}
]
},
{
"resolution_limits": [5.600,4.450],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.170
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 5.400
},
{
"type": "CC(1/2)",
"value": 0.959
}
]
},
{
"resolution_limits": [50.000,5.600],
"quality_factors": [
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 5.100
},
{
"type": "CC(1/2)",
"value": 0.968
}
]
}
]
}