Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a28712a768a0603101989441155aec0b",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 146.132,
"b": 146.132,
"c": 220.081,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97856],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.915,2.260],
"number_observations": 2108169,
"number_observations_unique": 124948,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.525
},
{
"type": "R(meas)",
"value": 0.541
},
{
"type": "I/SigI",
"value": 5.710
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 16.872
},
{
"type": "CC(1/2)",
"value": 0.983
}
]
},
"refln_shells": [
{
"resolution_limits": [2.390,2.260],
"number_observations_unique": 17700,
"quality_factors": [
{
"type": "R(merge)",
"value": 7.313
},
{
"type": "R(meas)",
"value": 7.548
},
{
"type": "I/SigI",
"value": 0.030
},
{
"type": "Completeness",
"value": 86.300
},
{
"type": "Redundancy",
"value": 3.761
},
{
"type": "CC(1/2)",
"value": 0.173
}
]
},
{
"resolution_limits": [2.560,2.390],
"number_observations_unique": 18969,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.562
},
{
"type": "R(meas)",
"value": 3.646
},
{
"type": "I/SigI",
"value": 0.170
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 9.648
},
{
"type": "CC(1/2)",
"value": 0.569
}
]
},
{
"resolution_limits": [2.760,2.560],
"number_observations_unique": 17976,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.550
},
{
"type": "R(meas)",
"value": 1.585
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 16.278
},
{
"type": "CC(1/2)",
"value": 0.882
}
]
},
{
"resolution_limits": [3.020,2.760],
"number_observations_unique": 16574,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.690
},
{
"type": "R(meas)",
"value": 0.706
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 22.078
},
{
"type": "CC(1/2)",
"value": 0.965
}
]
},
{
"resolution_limits": [3.380,3.020],
"number_observations_unique": 15030,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.265
},
{
"type": "R(meas)",
"value": 0.271
},
{
"type": "I/SigI",
"value": 2.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 22.861
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
{
"resolution_limits": [3.900,3.380],
"number_observations_unique": 13311,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.155
},
{
"type": "R(meas)",
"value": 0.158
},
{
"type": "I/SigI",
"value": 6.160
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 22.599
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [4.770,3.900],
"number_observations_unique": 11322,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "R(meas)",
"value": 0.076
},
{
"type": "I/SigI",
"value": 14.560
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 22.404
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [6.710,4.770],
"number_observations_unique": 8902,
"quality_factors": [
{
"type": "I/SigI",
"value": 22.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 22.160
}
]
},
{
"resolution_limits": [47.915,6.710],
"number_observations_unique": 5163,
"quality_factors": [
{
"type": "I/SigI",
"value": 38.130
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 20.279
}
]
}
]
}