Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "893fcc2ea0c265a8818bc05b76e78b28",
"space_group_name": "C 1 2 1",
"unit_cell": {
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"b": 91.494,
"c": 69.606,
"alpha": 90.00,
"beta": 119.21,
"gamma": 90.00
},
"wavelengths": [0.98712,0.97955,0.97914],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [60.75,2.00],
"number_observations_unique": 26606,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "I/SigI",
"value": 12.500
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 7.470
}
]
},
"refln_shells": [
{
"resolution_limits": [2.07,2.00],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.52
},
{
"type": "I/SigI",
"value": 3.700
}
]
},
{
"resolution_limits": [2.15,2.07],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.426
},
{
"type": "I/SigI",
"value": 4.300
}
]
},
{
"resolution_limits": [2.25,2.15],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.357
},
{
"type": "I/SigI",
"value": 4.900
}
]
},
{
"resolution_limits": [2.37,2.25],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.267
},
{
"type": "I/SigI",
"value": 6.200
}
]
},
{
"resolution_limits": [2.52,2.37],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.203
},
{
"type": "I/SigI",
"value": 7.700
}
]
},
{
"resolution_limits": [2.71,2.52],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.15
},
{
"type": "I/SigI",
"value": 10.000
}
]
},
{
"resolution_limits": [2.99,2.71],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.096
},
{
"type": "I/SigI",
"value": 14.300
}
]
},
{
"resolution_limits": [3.42,2.99],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "I/SigI",
"value": 20.500
}
]
},
{
"resolution_limits": [4.31,3.42],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 27.000
}
]
},
{
"resolution_limits": [36.53,4.31],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.06
},
{
"type": "I/SigI",
"value": 26.400
}
]
}
]
}