Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "30d00747497e371e0afd9da07f590637",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 54.529,
"b": 64.256,
"c": 70.472,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98400],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.00,1.90],
"number_observations_unique": 19956,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "Completeness",
"value": 98.6
}
]
},
"refln_shells": [
{
"resolution_limits": [1.97,1.90],
"number_observations_unique": 1979,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.314
},
{
"type": "Completeness",
"value": 99.5
}
]
},
{
"resolution_limits": [2.05,1.97],
"number_observations_unique": 1971,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.236
},
{
"type": "Completeness",
"value": 99.7
}
]
},
{
"resolution_limits": [2.14,2.05],
"number_observations_unique": 1975,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.171
},
{
"type": "Completeness",
"value": 99.5
}
]
},
{
"resolution_limits": [2.25,2.14],
"number_observations_unique": 1975,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.13
},
{
"type": "Completeness",
"value": 99.1
}
]
},
{
"resolution_limits": [2.39,2.25],
"number_observations_unique": 2007,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.106
},
{
"type": "Completeness",
"value": 99.9
}
]
},
{
"resolution_limits": [2.58,2.39],
"number_observations_unique": 1998,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.091
},
{
"type": "Completeness",
"value": 99.8
}
]
},
{
"resolution_limits": [2.84,2.58],
"number_observations_unique": 2010,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "Completeness",
"value": 99.9
}
]
},
{
"resolution_limits": [3.25,2.84],
"number_observations_unique": 2017,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.061
},
{
"type": "Completeness",
"value": 99.2
}
]
},
{
"resolution_limits": [4.09,3.25],
"number_observations_unique": 2009,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.035
},
{
"type": "Completeness",
"value": 97.8
}
]
},
{
"resolution_limits": [50.00,4.09],
"number_observations_unique": 2015,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "Completeness",
"value": 92.3
}
]
}
]
}