Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "6a32fe0076042e4cb38cae78deff96a1",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 34.925,
"b": 39.224,
"c": 104.674,
"alpha": 90.00,
"beta": 97.95,
"gamma": 90.00
},
"wavelengths": [1.60390],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.22,2.10],
"number_observations": 104888,
"number_observations_unique": 15890,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.067
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 15.3
},
{
"type": "Completeness",
"value": 95.8
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.21,2.10],
"number_observations": 14315,
"number_observations_unique": 2224,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.768
},
{
"type": "R(meas)",
"value": 0.912
},
{
"type": "R(pim)",
"value": 0.351
},
{
"type": "I/SigI",
"value": 1.9
},
{
"type": "Redundancy",
"value": 6.4
},
{
"type": "CC(1/2)",
"value": 0.842
}
]
}
]
}