Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d11382362d1a087e28c4f9b6de965ff4",
"space_group_name": "P 61",
"unit_cell": {
"a": 98.21,
"b": 98.21,
"c": 82.09,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [20.0,1.600],
"number_observations_unique": 57165,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "I/SigI",
"value": 17.920
},
{
"type": "Completeness",
"value": 96.400
},
{
"type": "Redundancy",
"value": 7.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.640,1.600],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.797
},
{
"type": "I/SigI",
"value": 2.460
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.690,1.640],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.633
},
{
"type": "I/SigI",
"value": 3.090
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.740,1.690],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.540
},
{
"type": "I/SigI",
"value": 3.810
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.790,1.740],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.429
},
{
"type": "I/SigI",
"value": 4.540
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.850,1.790],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.349
},
{
"type": "I/SigI",
"value": 5.620
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.910,1.850],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.331
},
{
"type": "I/SigI",
"value": 6.260
},
{
"type": "Completeness",
"value": 93.800
}
]
},
{
"resolution_limits": [1.980,1.910],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.242
},
{
"type": "I/SigI",
"value": 8.630
},
{
"type": "Completeness",
"value": 82.800
}
]
},
{
"resolution_limits": [2.070,1.980],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.177
},
{
"type": "I/SigI",
"value": 10.890
},
{
"type": "Completeness",
"value": 94.700
}
]
},
{
"resolution_limits": [2.160,2.070],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.137
},
{
"type": "I/SigI",
"value": 14.160
},
{
"type": "Completeness",
"value": 87.400
}
]
},
{
"resolution_limits": [2.260,2.160],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.111
},
{
"type": "I/SigI",
"value": 16.710
},
{
"type": "Completeness",
"value": 85.300
}
]
},
{
"resolution_limits": [2.390,2.260],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.091
},
{
"type": "I/SigI",
"value": 20.170
},
{
"type": "Completeness",
"value": 98.800
}
]
},
{
"resolution_limits": [2.530,2.390],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 23.790
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.700,2.530],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 26.710
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [2.920,2.700],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 32.770
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [3.200,2.920],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 39.620
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [3.580,3.200],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 46.560
},
{
"type": "Completeness",
"value": 96.400
}
]
},
{
"resolution_limits": [4.130,3.580],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 51.190
},
{
"type": "Completeness",
"value": 98.000
}
]
},
{
"resolution_limits": [5.060,4.130],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 58.180
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [7.160,5.060],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 57.040
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [20.0,7.160],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 62.610
},
{
"type": "Completeness",
"value": 95.100
}
]
}
]
}