Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0c625ad383765b40b86fb572508d2444",
"space_group_name": "P 61",
"unit_cell": {
"a": 98.27,
"b": 98.27,
"c": 82.05,
"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": 58841,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "I/SigI",
"value": 21.420
},
{
"type": "Completeness",
"value": 99.200
},
{
"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": 0.891
},
{
"type": "I/SigI",
"value": 2.130
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.690,1.640],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.713
},
{
"type": "I/SigI",
"value": 2.680
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.740,1.690],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.583
},
{
"type": "I/SigI",
"value": 3.390
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.790,1.740],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.462
},
{
"type": "I/SigI",
"value": 4.140
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.850,1.790],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.363
},
{
"type": "I/SigI",
"value": 5.280
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.910,1.850],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.329
},
{
"type": "I/SigI",
"value": 6.440
},
{
"type": "Completeness",
"value": 96.500
}
]
},
{
"resolution_limits": [1.980,1.910],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.218
},
{
"type": "I/SigI",
"value": 9.950
},
{
"type": "Completeness",
"value": 96.200
}
]
},
{
"resolution_limits": [2.070,1.980],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.171
},
{
"type": "I/SigI",
"value": 11.560
},
{
"type": "Completeness",
"value": 99.400
}
]
},
{
"resolution_limits": [2.160,2.070],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.130
},
{
"type": "I/SigI",
"value": 15.320
},
{
"type": "Completeness",
"value": 99.400
}
]
},
{
"resolution_limits": [2.260,2.160],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.103
},
{
"type": "I/SigI",
"value": 19.400
},
{
"type": "Completeness",
"value": 97.800
}
]
},
{
"resolution_limits": [2.390,2.260],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.082
},
{
"type": "I/SigI",
"value": 22.610
},
{
"type": "Completeness",
"value": 98.700
}
]
},
{
"resolution_limits": [2.530,2.390],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "I/SigI",
"value": 26.740
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [2.700,2.530],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 31.060
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [2.920,2.700],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 39.360
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [3.200,2.920],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 49.200
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [3.580,3.200],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 60.670
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [4.130,3.580],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 68.940
},
{
"type": "Completeness",
"value": 99.600
}
]
},
{
"resolution_limits": [5.060,4.130],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 77.690
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [7.160,5.060],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 75.780
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [20.0,7.160],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 85.470
},
{
"type": "Completeness",
"value": 95.100
}
]
}
]
}