Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2109d5ab47dc1fef4ddc3b59526469d3",
"space_group_name": "P 1",
"unit_cell": {
"a": 41.567,
"b": 61.622,
"c": 61.478,
"alpha": 114.12,
"beta": 89.99,
"gamma": 89.95
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,2.430],
"number_observations_unique": 19854,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "I/SigI",
"value": 18.500
},
{
"type": "Completeness",
"value": 95.600
},
{
"type": "Redundancy",
"value": 2.400
}
]
},
"refln_shells": [
{
"resolution_limits": [2.52,2.43],
"number_observations_unique": 1954,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.255
},
{
"type": "Completeness",
"value": 93.90
},
{
"type": "Redundancy",
"value": 2.30
}
]
},
{
"resolution_limits": [2.62,2.52],
"number_observations_unique": 1959,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.207
},
{
"type": "Completeness",
"value": 93.70
},
{
"type": "Redundancy",
"value": 2.40
}
]
},
{
"resolution_limits": [2.74,2.62],
"number_observations_unique": 1969,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.171
},
{
"type": "Completeness",
"value": 95.60
},
{
"type": "Redundancy",
"value": 2.40
}
]
},
{
"resolution_limits": [2.88,2.74],
"number_observations_unique": 1970,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.152
},
{
"type": "Completeness",
"value": 95.50
},
{
"type": "Redundancy",
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}
]
},
{
"resolution_limits": [3.06,2.88],
"number_observations_unique": 1988,
"quality_factors": [
{
"type": "R(merge)",
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},
{
"type": "Completeness",
"value": 95.00
},
{
"type": "Redundancy",
"value": 2.40
}
]
},
{
"resolution_limits": [3.30,3.06],
"number_observations_unique": 1980,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "Completeness",
"value": 95.80
},
{
"type": "Redundancy",
"value": 2.40
}
]
},
{
"resolution_limits": [3.63,3.30],
"number_observations_unique": 1985,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "Completeness",
"value": 95.80
},
{
"type": "Redundancy",
"value": 2.40
}
]
},
{
"resolution_limits": [4.15,3.63],
"number_observations_unique": 2022,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "Completeness",
"value": 95.50
},
{
"type": "Redundancy",
"value": 2.30
}
]
},
{
"resolution_limits": [5.23,4.15],
"number_observations_unique": 2006,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "Completeness",
"value": 97.10
},
{
"type": "Redundancy",
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}
]
},
{
"resolution_limits": [50.00,5.23],
"number_observations_unique": 2021,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "Completeness",
"value": 98.00
},
{
"type": "Redundancy",
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}
]
}
]
}