Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2e96336023f485d0be249a88385d940a",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 93.62,
"b": 93.62,
"c": 99.57,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91840,0.97939,0.97953],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.285,2.09],
"number_observations_unique": 29521,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "I/SigI",
"value": 8.840
},
{
"type": "Completeness",
"value": 97.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.16,2.09],
"number_observations": 16187,
"number_observations_unique": 4554,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.610
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 83.20
}
]
},
{
"resolution_limits": [2.25,2.16],
"number_observations": 22998,
"number_observations_unique": 5888,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.512
},
{
"type": "I/SigI",
"value": 2.8
},
{
"type": "Completeness",
"value": 97.80
}
]
},
{
"resolution_limits": [2.35,2.25],
"number_observations": 21861,
"number_observations_unique": 5597,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.422
},
{
"type": "I/SigI",
"value": 3.3
},
{
"type": "Completeness",
"value": 98.20
}
]
},
{
"resolution_limits": [2.48,2.35],
"number_observations": 23300,
"number_observations_unique": 5953,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.329
},
{
"type": "I/SigI",
"value": 4.1
},
{
"type": "Completeness",
"value": 97.90
}
]
},
{
"resolution_limits": [2.63,2.48],
"number_observations": 21407,
"number_observations_unique": 5471,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.245
},
{
"type": "I/SigI",
"value": 5.3
},
{
"type": "Completeness",
"value": 97.70
}
]
},
{
"resolution_limits": [2.83,2.63],
"number_observations": 21976,
"number_observations_unique": 5638,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.169
},
{
"type": "I/SigI",
"value": 7.3
},
{
"type": "Completeness",
"value": 98.60
}
]
},
{
"resolution_limits": [3.12,2.83],
"number_observations": 22795,
"number_observations_unique": 5864,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.116
},
{
"type": "I/SigI",
"value": 9.7
},
{
"type": "Completeness",
"value": 98.50
}
]
},
{
"resolution_limits": [3.57,3.12],
"number_observations": 21973,
"number_observations_unique": 5702,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "I/SigI",
"value": 13.8
},
{
"type": "Completeness",
"value": 98.90
}
]
},
{
"resolution_limits": [4.49,3.57],
"number_observations": 21637,
"number_observations_unique": 5741,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 18.1
},
{
"type": "Completeness",
"value": 99.20
}
]
},
{
"resolution_limits": [29.285,4.49],
"number_observations": 22122,
"number_observations_unique": 5795,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 20.5
},
{
"type": "Completeness",
"value": 98.70
}
]
}
]
}