Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cc03bda95d852b403c34d0c546a066aa",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 97.26,
"b": 201.72,
"c": 97.28,
"alpha": 90.00,
"beta": 93.71,
"gamma": 90.00
},
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [100.860,2.400],
"number_observations_unique": 140149,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "I/SigI",
"value": 9.400
},
{
"type": "Completeness",
"value": 96.400
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
"refln_shells": [
{
"resolution_limits": [2.530,2.400],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.544
},
{
"type": "I/SigI",
"value": 1.300
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 3.200
}
]
},
{
"resolution_limits": [2.680,2.530],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.382
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 3.200
}
]
},
{
"resolution_limits": [2.870,2.680],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.260
},
{
"type": "I/SigI",
"value": 2.800
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
{
"resolution_limits": [3.100,2.870],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.160
},
{
"type": "I/SigI",
"value": 4.600
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
{
"resolution_limits": [3.390,3.100],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.101
},
{
"type": "I/SigI",
"value": 6.900
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
{
"resolution_limits": [3.790,3.390],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "I/SigI",
"value": 9.600
},
{
"type": "Completeness",
"value": 96.500
},
{
"type": "Redundancy",
"value": 3.400
}
]
},
{
"resolution_limits": [4.380,3.790],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 12.000
},
{
"type": "Completeness",
"value": 95.600
},
{
"type": "Redundancy",
"value": 3.400
}
]
},
{
"resolution_limits": [5.370,4.380],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 13.300
},
{
"type": "Completeness",
"value": 94.600
},
{
"type": "Redundancy",
"value": 3.400
}
]
},
{
"resolution_limits": [7.590,5.370],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "I/SigI",
"value": 10.500
},
{
"type": "Completeness",
"value": 92.900
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
{
"resolution_limits": [44.752,7.590],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 14.500
},
{
"type": "Completeness",
"value": 89.100
},
{
"type": "Redundancy",
"value": 3.200
}
]
}
]
}