Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3fd2002414e06cc3f0bd2a72e0090f89",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 199.166,
"b": 199.166,
"c": 117.736,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000,1.73750],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,2.400],
"number_observations": 1184361,
"number_observations_unique": 53708,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.101
},
{
"type": "I/SigI",
"value": 7.300
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 22.100
}
]
},
"refln_shells": [
{
"resolution_limits": [2.490,2.400],
"number_observations_unique": 5286,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.860
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 21.000
}
]
},
{
"resolution_limits": [2.590,2.490],
"number_observations_unique": 5230,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.669
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 21.700
}
]
},
{
"resolution_limits": [2.700,2.590],
"number_observations_unique": 5268,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.489
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 22.200
}
]
},
{
"resolution_limits": [2.850,2.700],
"number_observations_unique": 5310,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.355
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 22.500
}
]
},
{
"resolution_limits": [3.020,2.850],
"number_observations_unique": 5308,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.254
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 22.600
}
]
},
{
"resolution_limits": [3.260,3.020],
"number_observations_unique": 5341,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.149
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 22.600
}
]
},
{
"resolution_limits": [3.580,3.260],
"number_observations_unique": 5353,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.102
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 22.500
}
]
},
{
"resolution_limits": [4.100,3.580],
"number_observations_unique": 5394,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 22.400
}
]
},
{
"resolution_limits": [5.170,4.100],
"number_observations_unique": 5472,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 22.100
}
]
},
{
"resolution_limits": [50.000,5.170],
"number_observations_unique": 5746,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 21.100
}
]
}
]
}