Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1de3b9f06d245663798a70c64151e35a",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 43.37,
"b": 94.40,
"c": 154.99,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97949],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [100.0,2.700],
"number_observations_unique": 17708,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "I/SigI",
"value": 14.4
},
{
"type": "Completeness",
"value": 97.2
},
{
"type": "Redundancy",
"value": 6.56
}
]
},
"refln_shells": [
{
"resolution_limits": [2.770,2.700],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.848
},
{
"type": "I/SigI",
"value": 2.850
},
{
"type": "Completeness",
"value": 95.8
}
]
},
{
"resolution_limits": [2.850,2.770],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.694
},
{
"type": "I/SigI",
"value": 3.490
},
{
"type": "Completeness",
"value": 98.9
}
]
},
{
"resolution_limits": [2.930,2.850],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.534
},
{
"type": "I/SigI",
"value": 4.410
},
{
"type": "Completeness",
"value": 99.4
}
]
},
{
"resolution_limits": [3.020,2.930],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.427
},
{
"type": "I/SigI",
"value": 5.480
},
{
"type": "Completeness",
"value": 99.2
}
]
},
{
"resolution_limits": [3.120,3.020],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.254
},
{
"type": "I/SigI",
"value": 7.480
},
{
"type": "Completeness",
"value": 98.9
}
]
},
{
"resolution_limits": [3.230,3.120],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.158
},
{
"type": "I/SigI",
"value": 10.440
},
{
"type": "Completeness",
"value": 98.7
}
]
},
{
"resolution_limits": [3.350,3.230],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.129
},
{
"type": "I/SigI",
"value": 12.890
},
{
"type": "Completeness",
"value": 98.5
}
]
},
{
"resolution_limits": [3.490,3.350],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.117
},
{
"type": "I/SigI",
"value": 14.820
},
{
"type": "Completeness",
"value": 97.5
}
]
},
{
"resolution_limits": [3.640,3.490],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.103
},
{
"type": "I/SigI",
"value": 16.640
},
{
"type": "Completeness",
"value": 96.7
}
]
},
{
"resolution_limits": [3.820,3.640],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.091
},
{
"type": "I/SigI",
"value": 18.780
},
{
"type": "Completeness",
"value": 97.7
}
]
},
{
"resolution_limits": [4.030,3.820],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "I/SigI",
"value": 19.700
},
{
"type": "Completeness",
"value": 97.1
}
]
},
{
"resolution_limits": [4.270,4.030],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 22.110
},
{
"type": "Completeness",
"value": 96.7
}
]
},
{
"resolution_limits": [4.560,4.270],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "I/SigI",
"value": 23.010
},
{
"type": "Completeness",
"value": 97.5
}
]
},
{
"resolution_limits": [4.930,4.560],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "I/SigI",
"value": 23.330
},
{
"type": "Completeness",
"value": 97.0
}
]
},
{
"resolution_limits": [5.400,4.930],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "I/SigI",
"value": 24.430
},
{
"type": "Completeness",
"value": 98.5
}
]
},
{
"resolution_limits": [6.040,5.400],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "I/SigI",
"value": 25.700
},
{
"type": "Completeness",
"value": 98.8
}
]
},
{
"resolution_limits": [6.970,6.040],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "I/SigI",
"value": 26.100
},
{
"type": "Completeness",
"value": 98.3
}
]
},
{
"resolution_limits": [8.540,6.970],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 26.880
},
{
"type": "Completeness",
"value": 96.7
}
]
},
{
"resolution_limits": [12.080,8.540],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "I/SigI",
"value": 26.110
},
{
"type": "Completeness",
"value": 87.3
}
]
},
{
"resolution_limits": [100.0,12.080],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 23.980
},
{
"type": "Completeness",
"value": 63.8
}
]
}
]
}