Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6552a60eb3bca0548a8dd88d9d929271",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 161.34,
"b": 176.30,
"c": 57.85,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [119.023,2.400],
"number_observations_unique": 32351,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.110
},
{
"type": "I/SigI",
"value": 8.600
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 3.200
}
]
},
"refln_shells": [
{
"resolution_limits": [2.530,2.400],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.684
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 96.800
},
{
"type": "Redundancy",
"value": 2.900
}
]
},
{
"resolution_limits": [2.680,2.530],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.512
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 3.100
}
]
},
{
"resolution_limits": [2.870,2.680],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.360
},
{
"type": "I/SigI",
"value": 2.100
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
{
"resolution_limits": [3.100,2.870],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.245
},
{
"type": "I/SigI",
"value": 3.000
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 3.300
}
]
},
{
"resolution_limits": [3.390,3.100],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.148
},
{
"type": "I/SigI",
"value": 5.000
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 3.200
}
]
},
{
"resolution_limits": [3.790,3.390],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "I/SigI",
"value": 8.500
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 2.900
}
]
},
{
"resolution_limits": [4.380,3.790],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 11.400
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 3.500
}
]
},
{
"resolution_limits": [5.370,4.380],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 13.000
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 3.500
}
]
},
{
"resolution_limits": [7.590,5.370],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 13.300
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 3.000
}
]
},
{
"resolution_limits": [51.440,7.590],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 18.200
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 3.600
}
]
}
]
}