Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "02e4eeda0389996d7e3f9e0598de66d2",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 45.11,
"b": 45.11,
"c": 246.80,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.066,1.600],
"number_observations_unique": 39609,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 27.150
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 6.8
}
]
},
"refln_shells": [
{
"resolution_limits": [1.640,1.600],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.432
},
{
"type": "I/SigI",
"value": 3.160
},
{
"type": "Completeness",
"value": 93.400
}
]
},
{
"resolution_limits": [1.690,1.640],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.344
},
{
"type": "I/SigI",
"value": 4.440
},
{
"type": "Completeness",
"value": 98.800
}
]
},
{
"resolution_limits": [1.740,1.690],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.255
},
{
"type": "I/SigI",
"value": 6.500
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [1.790,1.740],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.215
},
{
"type": "I/SigI",
"value": 8.090
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [1.850,1.790],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.175
},
{
"type": "I/SigI",
"value": 9.990
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [1.910,1.850],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.141
},
{
"type": "I/SigI",
"value": 12.450
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [1.980,1.910],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.108
},
{
"type": "I/SigI",
"value": 16.660
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [2.070,1.980],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "I/SigI",
"value": 21.210
},
{
"type": "Completeness",
"value": 99.700
}
]
},
{
"resolution_limits": [2.160,2.070],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "I/SigI",
"value": 26.690
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [2.260,2.160],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 31.200
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [2.390,2.260],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 35.690
},
{
"type": "Completeness",
"value": 99.300
}
]
},
{
"resolution_limits": [2.530,2.390],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "I/SigI",
"value": 39.250
},
{
"type": "Completeness",
"value": 99.500
}
]
},
{
"resolution_limits": [2.700,2.530],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 43.170
},
{
"type": "Completeness",
"value": 99.100
}
]
},
{
"resolution_limits": [2.920,2.700],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 50.210
},
{
"type": "Completeness",
"value": 99.200
}
]
},
{
"resolution_limits": [3.200,2.920],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 55.760
},
{
"type": "Completeness",
"value": 99.200
}
]
},
{
"resolution_limits": [3.580,3.200],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 61.250
},
{
"type": "Completeness",
"value": 98.400
}
]
},
{
"resolution_limits": [4.130,3.580],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 64.440
},
{
"type": "Completeness",
"value": 99.500
}
]
},
{
"resolution_limits": [5.060,4.130],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 66.020
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [7.160,5.060],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 63.950
},
{
"type": "Completeness",
"value": 99.700
}
]
},
{
"resolution_limits": [39.066,7.160],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 62.460
},
{
"type": "Completeness",
"value": 97.500
}
]
}
]
}