Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "332aab1a7377f2e9a21f32b323f71221",
"space_group_name": "P 1",
"unit_cell": {
"a": 65.522,
"b": 101.211,
"c": 101.436,
"alpha": 109.71,
"beta": 108.86,
"gamma": 101.36
},
"wavelengths": [0.97940],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.396,2.38],
"number_observations_unique": 76631,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "I/SigI",
"value": 6.530
},
{
"type": "Completeness",
"value": 84.900
}
]
},
"refln_shells": [
{
"resolution_limits": [2.460,2.380],
"number_observations": 25297,
"number_observations_unique": 13065,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.497
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Completeness",
"value": 78.900
}
]
},
{
"resolution_limits": [2.560,2.460],
"number_observations": 31815,
"number_observations_unique": 16077,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.425
},
{
"type": "I/SigI",
"value": 1.9
},
{
"type": "Completeness",
"value": 89.900
}
]
},
{
"resolution_limits": [2.680,2.560],
"number_observations": 31734,
"number_observations_unique": 16048,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.307
},
{
"type": "I/SigI",
"value": 2.5
},
{
"type": "Completeness",
"value": 88.500
}
]
},
{
"resolution_limits": [2.820,2.680],
"number_observations": 28347,
"number_observations_unique": 14427,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.228
},
{
"type": "I/SigI",
"value": 3.3
},
{
"type": "Completeness",
"value": 82.900
}
]
},
{
"resolution_limits": [3.000,2.820],
"number_observations": 31306,
"number_observations_unique": 15823,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.161
},
{
"type": "I/SigI",
"value": 4.5
},
{
"type": "Completeness",
"value": 88.700
}
]
},
{
"resolution_limits": [3.230,3.000],
"number_observations": 30159,
"number_observations_unique": 15275,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.116
},
{
"type": "I/SigI",
"value": 6.2
},
{
"type": "Completeness",
"value": 87.900
}
]
},
{
"resolution_limits": [3.550,3.230],
"number_observations": 28042,
"number_observations_unique": 14258,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "I/SigI",
"value": 7.9
},
{
"type": "Completeness",
"value": 82.500
}
]
},
{
"resolution_limits": [4.060,3.550],
"number_observations": 29514,
"number_observations_unique": 14931,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 10.9
},
{
"type": "Completeness",
"value": 84.700
}
]
},
{
"resolution_limits": [5.100,4.060],
"number_observations": 28194,
"number_observations_unique": 14350,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 13.1
},
{
"type": "Completeness",
"value": 82.000
}
]
},
{
"resolution_limits": [49.396,5.100],
"number_observations": 29002,
"number_observations_unique": 14737,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 13.9
},
{
"type": "Completeness",
"value": 82.600
}
]
}
]
}