Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7e2a8f905ba876b937469ec04d25cde8",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 43.778,
"b": 86.299,
"c": 65.534,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [2.90000,3.90000,0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.042,1.8],
"number_observations_unique": 23338,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.159
},
{
"type": "R(pim)",
"value": 0.061
},
{
"type": "I/SigI",
"value": 8.4
},
{
"type": "Completeness",
"value": 79.5
},
{
"type": "Redundancy",
"value": 5.2
}
]
},
"refln_shells": [
{
"resolution_limits": [1.90,1.80],
"number_observations_unique": 1806,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.202
},
{
"type": "R(pim)",
"value": 0.112
},
{
"type": "I/SigI",
"value": 4.9
},
{
"type": "Completeness",
"value": 54.3
},
{
"type": "Redundancy",
"value": 2.8
}
]
},
{
"resolution_limits": [1.90,1.80],
"number_observations_unique": 3389,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.070
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 20.5
},
{
"type": "Completeness",
"value": 99.5
},
{
"type": "Redundancy",
"value": 6.6
}
]
}
]
}