Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c63a92d322b2286af06f6342dc57c6bf",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 156.962,
"b": 56.112,
"c": 50.678,
"alpha": 90.00,
"beta": 90.66,
"gamma": 90.00
},
"wavelengths": [0.91590],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [78.480,1.600],
"number_observations": 387422,
"number_observations_unique": 58273,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.110
},
{
"type": "R(meas)",
"value": 0.119
},
{
"type": "R(pim)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 10.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.630,1.600],
"number_observations": 19275,
"number_observations_unique": 2853,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.071
},
{
"type": "R(meas)",
"value": 1.159
},
{
"type": "R(pim)",
"value": 0.440
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.800
},
{
"type": "CC(1/2)",
"value": 0.647
}
]
},
{
"resolution_limits": [78.480,8.760],
"number_observations": 2681,
"number_observations_unique": 388,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "R(meas)",
"value": 0.026
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 47.600
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}