Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4a13e6c4a462fdf663151dc106ad4761",
"space_group_name": "P 63",
"unit_cell": {
"a": 83.061,
"b": 83.061,
"c": 38.907,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40.000,1.649],
"number_observations_unique": 18539,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "I/SigI",
"value": 13.900
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 9.700
}
]
},
"refln_shells": [
{
"resolution_limits": [1.71,1.649],
"number_observations_unique": 1710,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.469
},
{
"type": "Completeness",
"value": 92.80
},
{
"type": "Redundancy",
"value": 4.60
}
]
},
{
"resolution_limits": [1.78,1.71],
"number_observations_unique": 1865,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.356
},
{
"type": "Completeness",
"value": 99.60
},
{
"type": "Redundancy",
"value": 7.10
}
]
},
{
"resolution_limits": [1.86,1.78],
"number_observations_unique": 1846,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.274
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 10.40
}
]
},
{
"resolution_limits": [1.96,1.86],
"number_observations_unique": 1837,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.191
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 10.60
}
]
},
{
"resolution_limits": [2.08,1.96],
"number_observations_unique": 1870,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.137
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 10.60
}
]
},
{
"resolution_limits": [2.24,2.08],
"number_observations_unique": 1864,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.104
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 10.70
}
]
},
{
"resolution_limits": [2.46,2.24],
"number_observations_unique": 1858,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 10.70
}
]
},
{
"resolution_limits": [2.82,2.46],
"number_observations_unique": 1869,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 10.80
}
]
},
{
"resolution_limits": [3.55,2.82],
"number_observations_unique": 1893,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 10.70
}
]
},
{
"resolution_limits": [40.00,3.55],
"number_observations_unique": 1927,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "Completeness",
"value": 99.80
},
{
"type": "Redundancy",
"value": 10.00
}
]
}
]
}