Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0de008cb95ee72f3251748dcbf4c1aa1",
"space_group_name": "P 1 2 1",
"unit_cell": {
"a": 52.582,
"b": 38.735,
"c": 82.034,
"alpha": 90.00,
"beta": 90.28,
"gamma": 90.00
},
"wavelengths": [0.89430],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.000,1.600],
"number_observations": 326242,
"number_observations_unique": 43906,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 24.360
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 7.430
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.700,1.600],
"number_observations_unique": 7214,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.717
},
{
"type": "R(meas)",
"value": 0.771
},
{
"type": "I/SigI",
"value": 3.180
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 7.497
},
{
"type": "CC(1/2)",
"value": 0.909
}
]
},
{
"resolution_limits": [1.800,1.700],
"number_observations_unique": 5712,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.413
},
{
"type": "R(meas)",
"value": 0.444
},
{
"type": "I/SigI",
"value": 5.360
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 7.528
},
{
"type": "CC(1/2)",
"value": 0.966
}
]
},
{
"resolution_limits": [2.000,1.800],
"number_observations_unique": 8316,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.191
},
{
"type": "R(meas)",
"value": 0.205
},
{
"type": "I/SigI",
"value": 10.560
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 7.548
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
{
"resolution_limits": [3.000,2.000],
"number_observations_unique": 15852,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(meas)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 32.330
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.467
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [4.000,3.000],
"number_observations_unique": 3910,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "R(meas)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 58.780
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.126
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [6.000,4.000],
"number_observations_unique": 2042,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.026
},
{
"type": "R(meas)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 64.550
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.099
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [8.000,6.000],
"number_observations_unique": 514,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(meas)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 64.010
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.979
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [10.000,8.000],
"number_observations_unique": 175,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "R(meas)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 63.050
},
{
"type": "Completeness",
"value": 95.600
},
{
"type": "Redundancy",
"value": 6.440
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [30.000,10.000],
"number_observations_unique": 171,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "R(meas)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 58.000
},
{
"type": "Completeness",
"value": 80.300
},
{
"type": "Redundancy",
"value": 5.544
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}