Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "925210ccf77022edc996885967bcc652",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 152.39,
"b": 152.39,
"c": 177.95,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.03317],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.515,2.600],
"number_observations_unique": 64793,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.114
},
{
"type": "R(meas)",
"value": 0.123
},
{
"type": "I/SigI",
"value": 17.110
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 7.326
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.670,2.600],
"number_observations_unique": 4736,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.536
},
{
"type": "R(meas)",
"value": 0.576
},
{
"type": "I/SigI",
"value": 4.010
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.345
},
{
"type": "CC(1/2)",
"value": 0.885
}
]
},
{
"resolution_limits": [2.740,2.670],
"number_observations_unique": 4585,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.466
},
{
"type": "R(meas)",
"value": 0.500
},
{
"type": "I/SigI",
"value": 4.610
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.399
},
{
"type": "CC(1/2)",
"value": 0.922
}
]
},
{
"resolution_limits": [2.820,2.740],
"number_observations_unique": 4514,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.402
},
{
"type": "R(meas)",
"value": 0.431
},
{
"type": "I/SigI",
"value": 5.310
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.423
},
{
"type": "CC(1/2)",
"value": 0.938
}
]
},
{
"resolution_limits": [2.910,2.820],
"number_observations_unique": 4334,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.337
},
{
"type": "R(meas)",
"value": 0.362
},
{
"type": "I/SigI",
"value": 6.370
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.442
},
{
"type": "CC(1/2)",
"value": 0.955
}
]
},
{
"resolution_limits": [3.000,2.910],
"number_observations_unique": 4244,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.274
},
{
"type": "R(meas)",
"value": 0.294
},
{
"type": "I/SigI",
"value": 7.780
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.437
},
{
"type": "CC(1/2)",
"value": 0.970
}
]
},
{
"resolution_limits": [3.110,3.000],
"number_observations_unique": 4093,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.230
},
{
"type": "R(meas)",
"value": 0.246
},
{
"type": "I/SigI",
"value": 9.010
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.427
},
{
"type": "CC(1/2)",
"value": 0.979
}
]
},
{
"resolution_limits": [3.230,3.110],
"number_observations_unique": 3955,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.168
},
{
"type": "R(meas)",
"value": 0.181
},
{
"type": "I/SigI",
"value": 12.210
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.429
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
},
{
"resolution_limits": [3.360,3.230],
"number_observations_unique": 3825,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.146
},
{
"type": "R(meas)",
"value": 0.156
},
{
"type": "I/SigI",
"value": 14.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.410
},
{
"type": "CC(1/2)",
"value": 0.990
}
]
},
{
"resolution_limits": [3.510,3.360],
"number_observations_unique": 3652,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.115
},
{
"type": "R(meas)",
"value": 0.124
},
{
"type": "I/SigI",
"value": 17.060
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.375
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
{
"resolution_limits": [3.680,3.510],
"number_observations_unique": 3528,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "R(meas)",
"value": 0.104
},
{
"type": "I/SigI",
"value": 20.310
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.375
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [3.880,3.680],
"number_observations_unique": 3351,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(meas)",
"value": 0.087
},
{
"type": "I/SigI",
"value": 23.880
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.340
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [4.110,3.880],
"number_observations_unique": 3174,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "R(meas)",
"value": 0.073
},
{
"type": "I/SigI",
"value": 27.560
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 7.323
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [4.400,4.110],
"number_observations_unique": 2987,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "R(meas)",
"value": 0.069
},
{
"type": "I/SigI",
"value": 28.700
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 7.285
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [4.750,4.400],
"number_observations_unique": 2790,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "R(meas)",
"value": 0.068
},
{
"type": "I/SigI",
"value": 29.420
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 7.249
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [5.200,4.750],
"number_observations_unique": 2581,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "R(meas)",
"value": 0.064
},
{
"type": "I/SigI",
"value": 30.690
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 7.175
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [5.810,5.200],
"number_observations_unique": 2350,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "R(meas)",
"value": 0.075
},
{
"type": "I/SigI",
"value": 26.790
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 7.071
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [6.710,5.810],
"number_observations_unique": 2080,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "R(meas)",
"value": 0.079
},
{
"type": "I/SigI",
"value": 25.150
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 7.124
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [8.220,6.710],
"number_observations_unique": 1782,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "R(meas)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 35.910
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 7.171
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [11.630,8.220],
"number_observations_unique": 1419,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 52.780
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 6.915
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [46.515,11.630],
"number_observations_unique": 813,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(meas)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 52.370
},
{
"type": "Completeness",
"value": 93.900
},
{
"type": "Redundancy",
"value": 6.394
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}