Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a22b0e91da68ffe4e7771e5cd2ae60a1",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 83.94,
"b": 105.58,
"c": 114.51,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.94,2.400],
"number_observations_unique": 40511,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 29.540
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.28
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.600,2.400],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.508
},
{
"type": "I/SigI",
"value": 5.880
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.79
}
]
},
{
"resolution_limits": [3.000,2.600],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.211
},
{
"type": "I/SigI",
"value": 12.430
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.27
}
]
},
{
"resolution_limits": [4.000,3.000],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "I/SigI",
"value": 36.630
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.40
}
]
},
{
"resolution_limits": [6.000,4.000],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 61.440
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 12.96
}
]
},
{
"resolution_limits": [8.000,6.000],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 65.130
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.79
}
]
},
{
"resolution_limits": [10.000,8.000],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 69.410
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 11.28
}
]
},
{
"resolution_limits": [12.000,10.000],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 68.620
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.05
}
]
},
{
"resolution_limits": [14.000,12.000],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 74.110
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.44
}
]
},
{
"resolution_limits": [20.000,14.000],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 72.440
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.77
}
]
},
{
"resolution_limits": [40.000,20.000],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 65.720
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.06
}
]
},
{
"resolution_limits": [47.94,40.000],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 55.310
},
{
"type": "Completeness",
"value": 37.500
},
{
"type": "Redundancy",
"value": 7.17
}
]
}
]
}