Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "ccc2e43d628c44125651ae18a8d66c1a",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 131.851,
"b": 131.851,
"c": 47.250,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [93.23,1.41],
"number_observations_unique": 80581,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.147
},
{
"type": "R(meas)",
"value": 0.153
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 7.9
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 24.4
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [93.23,7.72],
"number_observations_unique": 571,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.039
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 39.5
},
{
"type": "Completeness",
"value": 96.5
},
{
"type": "Redundancy",
"value": 17.7
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
{
"resolution_limits": [1.43,1.41],
"number_observations_unique": 3862,
"quality_factors": [
{
"type": "R(merge)",
"value": 9.571
},
{
"type": "R(meas)",
"value": 10.111
},
{
"type": "R(pim)",
"value": 3.240
},
{
"type": "I/SigI",
"value": 0.1
},
{
"type": "Completeness",
"value": 96.9
},
{
"type": "Redundancy",
"value": 18.4
},
{
"type": "CC(1/2)",
"value": 0.638
}
]
}
]
}