Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b1fab920344f39541ab4cea97849acbf",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 64.680,
"b": 64.680,
"c": 220.996,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.59,2.100],
"number_observations_unique": 32353,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.158
},
{
"type": "I/SigI",
"value": 9.090
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 9.52
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.150,2.100],
"quality_factors": [
{
"type": "R(merge)",
"value": 2.644
},
{
"type": "I/SigI",
"value": 0.790
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [2.210,2.150],
"quality_factors": [
{
"type": "R(merge)",
"value": 2.257
},
{
"type": "I/SigI",
"value": 0.990
},
{
"type": "Completeness",
"value": 99.600
}
]
},
{
"resolution_limits": [2.280,2.210],
"quality_factors": [
{
"type": "R(merge)",
"value": 1.924
},
{
"type": "I/SigI",
"value": 1.230
},
{
"type": "Completeness",
"value": 99.400
}
]
},
{
"resolution_limits": [2.350,2.280],
"quality_factors": [
{
"type": "R(merge)",
"value": 1.313
},
{
"type": "I/SigI",
"value": 1.780
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [2.430,2.350],
"quality_factors": [
{
"type": "R(merge)",
"value": 1.009
},
{
"type": "I/SigI",
"value": 2.330
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [2.510,2.430],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.812
},
{
"type": "I/SigI",
"value": 2.850
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [2.600,2.510],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.654
},
{
"type": "I/SigI",
"value": 3.600
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [2.710,2.600],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.513
},
{
"type": "I/SigI",
"value": 4.660
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [2.830,2.710],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.382
},
{
"type": "I/SigI",
"value": 6.250
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [2.970,2.830],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.283
},
{
"type": "I/SigI",
"value": 8.300
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [3.130,2.970],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.213
},
{
"type": "I/SigI",
"value": 10.630
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [3.320,3.130],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.150
},
{
"type": "I/SigI",
"value": 14.010
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [3.550,3.320],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.117
},
{
"type": "I/SigI",
"value": 17.510
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [3.830,3.550],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.107
},
{
"type": "I/SigI",
"value": 19.340
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [4.200,3.830],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.086
},
{
"type": "I/SigI",
"value": 22.410
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [4.700,4.200],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "I/SigI",
"value": 24.330
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [5.420,4.700],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "I/SigI",
"value": 23.880
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [6.640,5.420],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "I/SigI",
"value": 23.710
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [9.390,6.640],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 26.410
},
{
"type": "Completeness",
"value": 99.600
}
]
},
{
"resolution_limits": [44.59,9.390],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 29.940
},
{
"type": "Completeness",
"value": 98.000
}
]
}
]
}