Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8c78d87636a75a45c3213f5f5bea58be",
"space_group_name": "P 41",
"unit_cell": {
"a": 111.401,
"b": 111.401,
"c": 282.187,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.84160],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.0,2.300],
"number_observations_unique": 151348,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 19.81
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 4.3
}
]
},
"refln_shells": [
{
"resolution_limits": [2.400,2.300],
"number_observations": 79491,
"number_observations_unique": 18165,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.344
},
{
"type": "I/SigI",
"value": 5.190
},
{
"type": "Completeness",
"value": 100.0
}
]
},
{
"resolution_limits": [2.500,2.400],
"number_observations": 67230,
"number_observations_unique": 15345,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.281
},
{
"type": "I/SigI",
"value": 6.360
},
{
"type": "Completeness",
"value": 100.0
}
]
},
{
"resolution_limits": [3.000,2.500],
"number_observations": 217721,
"number_observations_unique": 49670,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.145
},
{
"type": "I/SigI",
"value": 10.350
},
{
"type": "Completeness",
"value": 99.9
}
]
},
{
"resolution_limits": [4.000,3.000],
"number_observations": 170654,
"number_observations_unique": 39461,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 25.180
},
{
"type": "Completeness",
"value": 99.9
}
]
},
{
"resolution_limits": [5.000,4.000],
"number_observations": 60054,
"number_observations_unique": 14078,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 43.980
},
{
"type": "Completeness",
"value": 100.0
}
]
},
{
"resolution_limits": [6.000,5.000],
"number_observations": 26430,
"number_observations_unique": 6240,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 43.880
},
{
"type": "Completeness",
"value": 99.9
}
]
},
{
"resolution_limits": [8.000,6.000],
"number_observations": 20924,
"number_observations_unique": 4978,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 46.840
},
{
"type": "Completeness",
"value": 99.8
}
]
},
{
"resolution_limits": [10.000,8.000],
"number_observations": 6982,
"number_observations_unique": 1725,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 53.450
},
{
"type": "Completeness",
"value": 97.5
}
]
},
{
"resolution_limits": [30.000,10.000],
"number_observations": 6343,
"number_observations_unique": 1686,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 47.910
},
{
"type": "Completeness",
"value": 89.8
}
]
}
]
}