Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f821f203695c81d3b6e33560c6678d1c",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 115.026,
"b": 122.284,
"c": 121.138,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [36.586,1.750],
"number_observations_unique": 85931,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.108
},
{
"type": "R(meas)",
"value": 0.117
},
{
"type": "I/SigI",
"value": 11.630
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 6.680
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.850,1.750],
"number_observations_unique": 13558,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.805
},
{
"type": "R(meas)",
"value": 0.871
},
{
"type": "I/SigI",
"value": 2.190
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 6.711
},
{
"type": "CC(1/2)",
"value": 0.809
}
]
},
{
"resolution_limits": [1.980,1.850],
"number_observations_unique": 12933,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.493
},
{
"type": "R(meas)",
"value": 0.536
},
{
"type": "I/SigI",
"value": 3.640
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 6.543
},
{
"type": "CC(1/2)",
"value": 0.916
}
]
},
{
"resolution_limits": [2.140,1.980],
"number_observations_unique": 12099,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.294
},
{
"type": "R(meas)",
"value": 0.319
},
{
"type": "I/SigI",
"value": 6.200
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.682
},
{
"type": "CC(1/2)",
"value": 0.962
}
]
},
{
"resolution_limits": [2.340,2.140],
"number_observations_unique": 11174,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.186
},
{
"type": "R(meas)",
"value": 0.200
},
{
"type": "I/SigI",
"value": 9.570
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.980
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
},
{
"resolution_limits": [2.620,2.340],
"number_observations_unique": 10142,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.138
},
{
"type": "R(meas)",
"value": 0.150
},
{
"type": "I/SigI",
"value": 12.330
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.768
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
{
"resolution_limits": [3.020,2.620],
"number_observations_unique": 8956,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.094
},
{
"type": "R(meas)",
"value": 0.103
},
{
"type": "I/SigI",
"value": 16.590
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.257
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
{
"resolution_limits": [3.700,3.020],
"number_observations_unique": 7646,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "R(meas)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 24.650
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.990
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [5.210,3.700],
"number_observations_unique": 5979,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.061
},
{
"type": "I/SigI",
"value": 29.560
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.476
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [36.586,5.210],
"number_observations_unique": 3444,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 29.540
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 6.606
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}