Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "088519f521daafbd9839fcefb670bb72",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 142.15,
"b": 142.15,
"c": 151.54,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97628],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.780,2.210],
"number_observations": 887820,
"number_observations_unique": 45740,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.149
},
{
"type": "R(meas)",
"value": 0.153
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 15.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.270,2.210],
"number_observations": 66857,
"number_observations_unique": 3309,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.495
},
{
"type": "R(meas)",
"value": 2.559
},
{
"type": "R(pim)",
"value": 0.566
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.200
},
{
"type": "CC(1/2)",
"value": 0.585
}
]
},
{
"resolution_limits": [47.780,9.880],
"number_observations": 9340,
"number_observations_unique": 620,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(meas)",
"value": 0.051
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 44.300
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 15.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}