Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "b6c45ef74c7218b27930486908ee8128",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 104.913,
"b": 104.913,
"c": 160.147,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.03,1.47],
"number_observations_unique": 172966,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(meas)",
"value": 0.086
},
{
"type": "I/SigI",
"value": 11.83
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 11.37
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.58,1.47],
"number_observations_unique": 18865,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.291
},
{
"type": "R(meas)",
"value": 2.796
},
{
"type": "I/SigI",
"value": 0.52
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "CC(1/2)",
"value": 0.489
}
]
},
{
"resolution_limits": [46.03,4.48],
"number_observations_unique": 6481,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "R(meas)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 42.79
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}