Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "cad82a92c452dc2e309359c5bf2e0f5f",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 208.323,
"b": 112.521,
"c": 188.732,
"alpha": 90.00,
"beta": 91.75,
"gamma": 90.00
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [94.322,1.928],
"number_observations": 1839934,
"number_observations_unique": 269514,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.135
},
{
"type": "R(pim)",
"value": 0.056
},
{
"type": "I/SigI",
"value": 9.0
},
{
"type": "Completeness",
"value": 95.7
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.070,1.928],
"number_observations": 95971,
"number_observations_unique": 13476,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.506
},
{
"type": "R(pim)",
"value": 0.608
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.379
}
]
},
{
"resolution_limits": [94.322,5.617],
"number_observations": 86125,
"number_observations_unique": 13475,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.057
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 22.2
},
{
"type": "Redundancy",
"value": 6.4
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
}
]
}