Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "acfbe6f2baf9145e24000f266d520d34",
"space_group_name": "F 4 3 2",
"unit_cell": {
"a": 268.126,
"b": 268.126,
"c": 268.126,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,2.600],
"number_observations_unique": 25873,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 21.700
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 12.200
}
]
},
"refln_shells": [
{
"resolution_limits": [2.690,2.600],
"number_observations_unique": 2488,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.363
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 6.900
}
]
},
{
"resolution_limits": [2.800,2.690],
"number_observations_unique": 2527,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.305
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 8.400
}
]
},
{
"resolution_limits": [2.930,2.800],
"number_observations_unique": 2530,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.244
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 9.300
}
]
},
{
"resolution_limits": [3.080,2.930],
"number_observations_unique": 2532,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.185
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 10.600
}
]
},
{
"resolution_limits": [3.280,3.080],
"number_observations_unique": 2558,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.128
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 12.000
}
]
},
{
"resolution_limits": [3.530,3.280],
"number_observations_unique": 2573,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 13.400
}
]
},
{
"resolution_limits": [3.880,3.530],
"number_observations_unique": 2584,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 14.600
}
]
},
{
"resolution_limits": [4.450,3.880],
"number_observations_unique": 2603,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 15.300
}
]
},
{
"resolution_limits": [5.600,4.450],
"number_observations_unique": 2652,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 15.500
}
]
},
{
"resolution_limits": [50.000,5.600],
"number_observations_unique": 2826,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 14.700
}
]
}
]
}