Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "70c843b26996049fffbff56ee4cdc771",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 46.97,
"b": 77.80,
"c": 78.61,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.300,1.650],
"number_observations": 208148,
"number_observations_unique": 34969,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.138
},
{
"type": "R(meas)",
"value": 0.151
},
{
"type": "I/SigI",
"value": 8.040
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 5.952
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [1.700,1.650],
"number_observations_unique": 2927,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.651
},
{
"type": "R(meas)",
"value": 0.710
},
{
"type": "I/SigI",
"value": 2.200
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 6.197
},
{
"type": "CC(1/2)",
"value": 0.825
}
]
},
{
"resolution_limits": [1.800,1.700],
"number_observations_unique": 4951,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.481
},
{
"type": "R(meas)",
"value": 0.527
},
{
"type": "I/SigI",
"value": 3.070
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 5.937
},
{
"type": "CC(1/2)",
"value": 0.902
}
]
},
{
"resolution_limits": [2.000,1.800],
"number_observations_unique": 7220,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.344
},
{
"type": "R(meas)",
"value": 0.375
},
{
"type": "I/SigI",
"value": 5.070
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 6.235
},
{
"type": "CC(1/2)",
"value": 0.955
}
]
},
{
"resolution_limits": [2.500,2.000],
"number_observations_unique": 9554,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.208
},
{
"type": "R(meas)",
"value": 0.228
},
{
"type": "I/SigI",
"value": 8.900
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 5.957
},
{
"type": "CC(1/2)",
"value": 0.981
}
]
},
{
"resolution_limits": [3.000,2.500],
"number_observations_unique": 4261,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.142
},
{
"type": "R(meas)",
"value": 0.157
},
{
"type": "I/SigI",
"value": 11.650
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 5.749
},
{
"type": "CC(1/2)",
"value": 0.980
}
]
},
{
"resolution_limits": [4.000,3.000],
"number_observations_unique": 3419,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.108
},
{
"type": "R(meas)",
"value": 0.119
},
{
"type": "I/SigI",
"value": 13.920
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 5.586
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
},
{
"resolution_limits": [10.000,4.000],
"number_observations_unique": 2442,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "R(meas)",
"value": 0.101
},
{
"type": "I/SigI",
"value": 15.400
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 5.751
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
{
"resolution_limits": [50.000,10.000],
"number_observations_unique": 194,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.076
},
{
"type": "R(meas)",
"value": 0.084
},
{
"type": "I/SigI",
"value": 15.730
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 5.407
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
{
"resolution_limits": [55.300,50.000],
"number_observations_unique": 1,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.026
},
{
"type": "R(meas)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 14.210
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 4.000
}
]
}
]
}