Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "365079b53bb87372f58780017c5e9040",
"space_group_name": "P 3 1 2",
"unit_cell": {
"a": 117.304,
"b": 117.304,
"c": 137.054,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [81.613,3.320],
"number_observations_unique": 15949,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.099
},
{
"type": "R(meas)",
"value": 0.104
},
{
"type": "I/SigI",
"value": 18.530
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 10.040
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [3.520,3.320],
"number_observations_unique": 2390,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.071
},
{
"type": "R(meas)",
"value": 1.131
},
{
"type": "I/SigI",
"value": 2.180
},
{
"type": "Completeness",
"value": 92.500
},
{
"type": "Redundancy",
"value": 9.469
},
{
"type": "CC(1/2)",
"value": 0.729
}
]
},
{
"resolution_limits": [3.770,3.520],
"number_observations_unique": 2436,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.598
},
{
"type": "R(meas)",
"value": 0.631
},
{
"type": "I/SigI",
"value": 4.230
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 9.951
},
{
"type": "CC(1/2)",
"value": 0.896
}
]
},
{
"resolution_limits": [4.070,3.770],
"number_observations_unique": 2248,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.317
},
{
"type": "R(meas)",
"value": 0.334
},
{
"type": "I/SigI",
"value": 7.860
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.167
},
{
"type": "CC(1/2)",
"value": 0.974
}
]
},
{
"resolution_limits": [4.460,4.070],
"number_observations_unique": 2085,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.186
},
{
"type": "R(meas)",
"value": 0.195
},
{
"type": "I/SigI",
"value": 13.440
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.743
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
},
{
"resolution_limits": [4.980,4.460],
"number_observations_unique": 1902,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.123
},
{
"type": "R(meas)",
"value": 0.130
},
{
"type": "I/SigI",
"value": 19.040
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.481
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
{
"resolution_limits": [5.750,4.980],
"number_observations_unique": 1676,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.110
},
{
"type": "R(meas)",
"value": 0.116
},
{
"type": "I/SigI",
"value": 20.690
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 9.749
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
{
"resolution_limits": [7.030,5.750],
"number_observations_unique": 1428,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(meas)",
"value": 0.081
},
{
"type": "I/SigI",
"value": 29.960
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.340
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [9.900,7.030],
"number_observations_unique": 1128,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.036
},
{
"type": "R(meas)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 60.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 9.792
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [81.613,9.900],
"number_observations_unique": 656,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(meas)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 79.490
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 9.020
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}