Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7dccd4c1eeabe84205023aeeec018095",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 436.63,
"b": 287.00,
"c": 304.73,
"alpha": 90.00,
"beta": 99.08,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [143.721,3.400],
"number_observations_unique": 1013190,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.297
},
{
"type": "R(meas)",
"value": 0.308
},
{
"type": "I/SigI",
"value": 9.210
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 15.171
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [3.500,3.400],
"number_observations_unique": 83925,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.554
},
{
"type": "R(meas)",
"value": 1.751
},
{
"type": "I/SigI",
"value": 0.980
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 4.683
},
{
"type": "CC(1/2)",
"value": 0.355
}
]
},
{
"resolution_limits": [3.600,3.500],
"number_observations_unique": 75016,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.602
},
{
"type": "R(meas)",
"value": 1.661
},
{
"type": "I/SigI",
"value": 1.820
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.290
},
{
"type": "CC(1/2)",
"value": 0.650
}
]
},
{
"resolution_limits": [3.700,3.600],
"number_observations_unique": 67266,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.346
},
{
"type": "R(meas)",
"value": 1.389
},
{
"type": "I/SigI",
"value": 2.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 16.473
},
{
"type": "CC(1/2)",
"value": 0.765
}
]
},
{
"resolution_limits": [3.800,3.700],
"number_observations_unique": 60322,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.056
},
{
"type": "R(meas)",
"value": 1.090
},
{
"type": "I/SigI",
"value": 3.060
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 16.113
},
{
"type": "CC(1/2)",
"value": 0.838
}
]
},
{
"resolution_limits": [3.900,3.800],
"number_observations_unique": 54312,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.857
},
{
"type": "R(meas)",
"value": 0.885
},
{
"type": "I/SigI",
"value": 3.710
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 15.674
},
{
"type": "CC(1/2)",
"value": 0.883
}
]
},
{
"resolution_limits": [4.000,3.900],
"number_observations_unique": 49014,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.730
},
{
"type": "R(meas)",
"value": 0.753
},
{
"type": "I/SigI",
"value": 4.470
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 16.639
},
{
"type": "CC(1/2)",
"value": 0.917
}
]
},
{
"resolution_limits": [4.500,4.000],
"number_observations_unique": 185010,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.493
},
{
"type": "R(meas)",
"value": 0.508
},
{
"type": "I/SigI",
"value": 6.470
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 16.330
},
{
"type": "CC(1/2)",
"value": 0.961
}
]
},
{
"resolution_limits": [5.000,4.500],
"number_observations_unique": 118417,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.306
},
{
"type": "R(meas)",
"value": 0.316
},
{
"type": "I/SigI",
"value": 9.940
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 16.206
},
{
"type": "CC(1/2)",
"value": 0.983
}
]
},
{
"resolution_limits": [7.500,5.000],
"number_observations_unique": 224575,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.201
},
{
"type": "R(meas)",
"value": 0.208
},
{
"type": "I/SigI",
"value": 14.540
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 16.409
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
{
"resolution_limits": [10.000,7.500],
"number_observations_unique": 54927,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.113
},
{
"type": "R(meas)",
"value": 0.117
},
{
"type": "I/SigI",
"value": 24.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 16.228
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [25.000,10.000],
"number_observations_unique": 37819,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "R(meas)",
"value": 0.078
},
{
"type": "I/SigI",
"value": 33.450
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 15.940
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [50.000,25.000],
"number_observations_unique": 2321,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "I/SigI",
"value": 44.100
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 15.957
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [75.000,50.000],
"number_observations_unique": 223,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(meas)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 37.420
},
{
"type": "Completeness",
"value": 90.700
},
{
"type": "Redundancy",
"value": 10.978
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [100.000,75.000],
"number_observations_unique": 37,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "R(meas)",
"value": 0.081
},
{
"type": "I/SigI",
"value": 27.150
},
{
"type": "Completeness",
"value": 60.700
},
{
"type": "Redundancy",
"value": 6.027
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
},
{
"resolution_limits": [105.000,100.000],
"number_observations_unique": 6,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.149
},
{
"type": "R(meas)",
"value": 0.202
},
{
"type": "I/SigI",
"value": 11.670
},
{
"type": "Completeness",
"value": 85.700
},
{
"type": "Redundancy",
"value": 2.000
}
]
},
{
"resolution_limits": [143.721,105.000],
"quality_factors": [
]
}
]
}