Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fdfa32ddabf91ed30173211d558921e9",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 91.99,
"b": 91.99,
"c": 106.22,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.87260],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.0,2.500],
"number_observations_unique": 16276,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.161
},
{
"type": "I/SigI",
"value": 11.520
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 9.1
}
]
},
"refln_shells": [
{
"resolution_limits": [2.560,2.500],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.998
},
{
"type": "I/SigI",
"value": 1.870
},
{
"type": "Completeness",
"value": 93.000
}
]
},
{
"resolution_limits": [2.630,2.560],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.819
},
{
"type": "I/SigI",
"value": 2.580
},
{
"type": "Completeness",
"value": 99.400
}
]
},
{
"resolution_limits": [2.710,2.630],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.716
},
{
"type": "I/SigI",
"value": 3.150
},
{
"type": "Completeness",
"value": 99.400
}
]
},
{
"resolution_limits": [2.790,2.710],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.610
},
{
"type": "I/SigI",
"value": 3.650
},
{
"type": "Completeness",
"value": 99.500
}
]
},
{
"resolution_limits": [2.880,2.790],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.497
},
{
"type": "I/SigI",
"value": 4.530
},
{
"type": "Completeness",
"value": 99.500
}
]
},
{
"resolution_limits": [2.980,2.880],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.401
},
{
"type": "I/SigI",
"value": 5.760
},
{
"type": "Completeness",
"value": 99.600
}
]
},
{
"resolution_limits": [3.100,2.980],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.339
},
{
"type": "I/SigI",
"value": 6.690
},
{
"type": "Completeness",
"value": 99.700
}
]
},
{
"resolution_limits": [3.220,3.100],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.279
},
{
"type": "I/SigI",
"value": 8.070
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [3.370,3.220],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.222
},
{
"type": "I/SigI",
"value": 10.500
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [3.530,3.370],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.181
},
{
"type": "I/SigI",
"value": 12.630
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [3.720,3.530],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.143
},
{
"type": "I/SigI",
"value": 15.090
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [3.950,3.720],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.128
},
{
"type": "I/SigI",
"value": 16.540
},
{
"type": "Completeness",
"value": 99.600
}
]
},
{
"resolution_limits": [4.220,3.950],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.102
},
{
"type": "I/SigI",
"value": 19.960
},
{
"type": "Completeness",
"value": 99.900
}
]
},
{
"resolution_limits": [4.560,4.220],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "I/SigI",
"value": 22.620
},
{
"type": "Completeness",
"value": 99.600
}
]
},
{
"resolution_limits": [4.990,4.560],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "I/SigI",
"value": 24.270
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [5.580,4.990],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "I/SigI",
"value": 22.460
},
{
"type": "Completeness",
"value": 99.700
}
]
},
{
"resolution_limits": [6.450,5.580],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.080
},
{
"type": "I/SigI",
"value": 22.870
},
{
"type": "Completeness",
"value": 100.000
}
]
},
{
"resolution_limits": [7.890,6.450],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "I/SigI",
"value": 25.950
},
{
"type": "Completeness",
"value": 99.800
}
]
},
{
"resolution_limits": [11.160,7.890],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 31.170
},
{
"type": "Completeness",
"value": 98.400
}
]
},
{
"resolution_limits": [50.0,11.160],
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 28.930
},
{
"type": "Completeness",
"value": 96.900
}
]
}
]
}