Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fa19445b7baf4e6808165c6f43cabdd2",
"space_group_name": "P 1",
"unit_cell": {
"a": 60.373,
"b": 60.402,
"c": 194.026,
"alpha": 89.92,
"beta": 89.96,
"gamma": 79.75
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.060,2.720],
"number_observations_unique": 70840,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "I/SigI",
"value": 5.000
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 1.920
}
]
},
"refln_shells": [
{
"resolution_limits": [2.820,2.720],
"number_observations": 13538,
"number_observations_unique": 7013,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.422
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 1.920
}
]
},
{
"resolution_limits": [2.930,2.820],
"number_observations": 13620,
"number_observations_unique": 7041,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.357
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 1.920
}
]
},
{
"resolution_limits": [3.060,2.930],
"number_observations": 13828,
"number_observations_unique": 7137,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.309
},
{
"type": "I/SigI",
"value": 2.300
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 1.920
}
]
},
{
"resolution_limits": [3.220,3.060],
"number_observations": 13729,
"number_observations_unique": 7106,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.244
},
{
"type": "I/SigI",
"value": 2.900
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 1.920
}
]
},
{
"resolution_limits": [3.430,3.220],
"number_observations": 13542,
"number_observations_unique": 7040,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.184
},
{
"type": "I/SigI",
"value": 3.900
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 1.910
}
]
},
{
"resolution_limits": [3.690,3.430],
"number_observations": 13780,
"number_observations_unique": 7173,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.151
},
{
"type": "I/SigI",
"value": 5.000
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 1.910
}
]
},
{
"resolution_limits": [4.060,3.690],
"number_observations": 13647,
"number_observations_unique": 7083,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.128
},
{
"type": "I/SigI",
"value": 6.100
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 1.920
}
]
},
{
"resolution_limits": [4.650,4.060],
"number_observations": 13855,
"number_observations_unique": 7156,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.118
},
{
"type": "I/SigI",
"value": 6.600
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 1.930
}
]
},
{
"resolution_limits": [5.860,4.650],
"number_observations": 13607,
"number_observations_unique": 7033,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.100
},
{
"type": "I/SigI",
"value": 7.700
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 1.920
}
]
},
{
"resolution_limits": [45.060,5.860],
"number_observations": 13754,
"number_observations_unique": 7058,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "I/SigI",
"value": 11.600
},
{
"type": "Completeness",
"value": 97.100
},
{
"type": "Redundancy",
"value": 1.920
}
]
}
]
}