Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c901fc706b7883710376fb33671845be",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 43.807,
"b": 95.591,
"c": 119.817,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.11587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,1.550],
"number_observations_unique": 72575,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "I/SigI",
"value": 13.500
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 5.600
}
]
},
"refln_shells": [
{
"resolution_limits": [1.610,1.550],
"number_observations_unique": 6419,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.508
},
{
"type": "Completeness",
"value": 88.100
},
{
"type": "Redundancy",
"value": 2.900
}
]
},
{
"resolution_limits": [1.670,1.610],
"number_observations_unique": 6963,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.407
},
{
"type": "Completeness",
"value": 95.200
},
{
"type": "Redundancy",
"value": 3.700
}
]
},
{
"resolution_limits": [1.750,1.670],
"number_observations_unique": 7208,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.326
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 5.200
}
]
},
{
"resolution_limits": [1.840,1.750],
"number_observations_unique": 7242,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.222
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 5.900
}
]
},
{
"resolution_limits": [1.950,1.840],
"number_observations_unique": 7302,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.144
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 6.000
}
]
},
{
"resolution_limits": [2.100,1.950],
"number_observations_unique": 7344,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.096
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 6.000
}
]
},
{
"resolution_limits": [2.320,2.100],
"number_observations_unique": 7371,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.200
}
]
},
{
"resolution_limits": [2.650,2.320],
"number_observations_unique": 7412,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.400
}
]
},
{
"resolution_limits": [3.340,2.650],
"number_observations_unique": 7504,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.600
}
]
},
{
"resolution_limits": [50.000,3.340],
"number_observations_unique": 7810,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.700
}
]
}
]
}