Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "34e84b6ee03d99b93d3becba0b708cd1",
"space_group_name": "P 43",
"unit_cell": {
"a": 88.351,
"b": 88.351,
"c": 39.008,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91258],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [88.380,1.110],
"number_observations": 654587,
"number_observations_unique": 118612,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.117
},
{
"type": "R(meas)",
"value": 0.128
},
{
"type": "R(pim)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 4.000
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 5.500
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.130,1.110],
"number_observations": 19910,
"number_observations_unique": 5708,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.647
},
{
"type": "R(meas)",
"value": 1.927
},
{
"type": "R(pim)",
"value": 0.980
},
{
"type": "I/SigI",
"value": 0.300
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 3.500
},
{
"type": "CC(1/2)",
"value": 0.422
}
]
},
{
"resolution_limits": [88.380,6.080],
"number_observations": 5451,
"number_observations_unique": 799,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "R(meas)",
"value": 0.055
},
{
"type": "R(pim)",
"value": 0.021
},
{
"type": "I/SigI",
"value": 13.600
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}