Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d873fa9aa928a7df9124c8ad6f495594",
"space_group_name": "H 3 2",
"unit_cell": {
"a": 129.50,
"b": 129.50,
"c": 160.01,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97872],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,2.250],
"number_observations_unique": 23840,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.048
},
{
"type": "R(meas)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 24.840
},
{
"type": "Completeness",
"value": 96.600
},
{
"type": "Redundancy",
"value": 6.429
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.310,2.250],
"number_observations_unique": 1768,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.560
},
{
"type": "R(meas)",
"value": 0.608
},
{
"type": "I/SigI",
"value": 3.270
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 6.402
},
{
"type": "CC(1/2)",
"value": 0.871
}
]
},
{
"resolution_limits": [2.370,2.310],
"number_observations_unique": 1725,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.459
},
{
"type": "R(meas)",
"value": 0.498
},
{
"type": "I/SigI",
"value": 4.010
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 6.395
},
{
"type": "CC(1/2)",
"value": 0.896
}
]
},
{
"resolution_limits": [2.440,2.370],
"number_observations_unique": 1687,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.363
},
{
"type": "R(meas)",
"value": 0.394
},
{
"type": "I/SigI",
"value": 5.090
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 6.443
},
{
"type": "CC(1/2)",
"value": 0.940
}
]
},
{
"resolution_limits": [2.520,2.440],
"number_observations_unique": 1613,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.288
},
{
"type": "R(meas)",
"value": 0.313
},
{
"type": "I/SigI",
"value": 6.350
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 6.386
},
{
"type": "CC(1/2)",
"value": 0.956
}
]
},
{
"resolution_limits": [2.600,2.520],
"number_observations_unique": 1580,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.244
},
{
"type": "R(meas)",
"value": 0.265
},
{
"type": "I/SigI",
"value": 7.530
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 6.454
},
{
"type": "CC(1/2)",
"value": 0.972
}
]
},
{
"resolution_limits": [2.690,2.600],
"number_observations_unique": 1523,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.191
},
{
"type": "R(meas)",
"value": 0.207
},
{
"type": "I/SigI",
"value": 9.640
},
{
"type": "Completeness",
"value": 97.600
},
{
"type": "Redundancy",
"value": 6.429
},
{
"type": "CC(1/2)",
"value": 0.980
}
]
},
{
"resolution_limits": [2.790,2.690],
"number_observations_unique": 1473,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.147
},
{
"type": "R(meas)",
"value": 0.160
},
{
"type": "I/SigI",
"value": 12.480
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 6.417
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
},
{
"resolution_limits": [2.900,2.790],
"number_observations_unique": 1408,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.109
},
{
"type": "R(meas)",
"value": 0.118
},
{
"type": "I/SigI",
"value": 16.150
},
{
"type": "Completeness",
"value": 97.000
},
{
"type": "Redundancy",
"value": 6.436
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
{
"resolution_limits": [3.030,2.900],
"number_observations_unique": 1353,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "R(meas)",
"value": 0.098
},
{
"type": "I/SigI",
"value": 19.410
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 6.452
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
{
"resolution_limits": [3.180,3.030],
"number_observations_unique": 1289,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(meas)",
"value": 0.076
},
{
"type": "I/SigI",
"value": 24.450
},
{
"type": "Completeness",
"value": 96.300
},
{
"type": "Redundancy",
"value": 6.469
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [3.350,3.180],
"number_observations_unique": 1227,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.058
},
{
"type": "I/SigI",
"value": 31.290
},
{
"type": "Completeness",
"value": 96.300
},
{
"type": "Redundancy",
"value": 6.465
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [3.560,3.350],
"number_observations_unique": 1155,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 39.320
},
{
"type": "Completeness",
"value": 95.900
},
{
"type": "Redundancy",
"value": 6.390
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [3.800,3.560],
"number_observations_unique": 1101,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 46.300
},
{
"type": "Completeness",
"value": 96.200
},
{
"type": "Redundancy",
"value": 6.483
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [4.110,3.800],
"number_observations_unique": 1010,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 53.660
},
{
"type": "Completeness",
"value": 95.400
},
{
"type": "Redundancy",
"value": 6.430
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [4.500,4.110],
"number_observations_unique": 926,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(meas)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 59.240
},
{
"type": "Completeness",
"value": 95.400
},
{
"type": "Redundancy",
"value": 6.494
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [5.030,4.500],
"number_observations_unique": 852,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "R(meas)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 61.490
},
{
"type": "Completeness",
"value": 94.700
},
{
"type": "Redundancy",
"value": 6.459
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [5.810,5.030],
"number_observations_unique": 746,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.022
},
{
"type": "R(meas)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 60.750
},
{
"type": "Completeness",
"value": 94.400
},
{
"type": "Redundancy",
"value": 6.523
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [7.120,5.810],
"number_observations_unique": 633,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "R(meas)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 62.220
},
{
"type": "Completeness",
"value": 93.400
},
{
"type": "Redundancy",
"value": 6.423
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
{
"resolution_limits": [10.060,7.120],
"number_observations_unique": 494,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.017
},
{
"type": "R(meas)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 70.000
},
{
"type": "Completeness",
"value": 92.500
},
{
"type": "Redundancy",
"value": 6.411
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
{
"resolution_limits": [50,10.060],
"number_observations_unique": 277,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.017
},
{
"type": "R(meas)",
"value": 0.018
},
{
"type": "I/SigI",
"value": 70.620
},
{
"type": "Completeness",
"value": 87.700
},
{
"type": "Redundancy",
"value": 5.827
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}