Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b2ceae92dc3ce9545d7173e1a955daaf",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 27.230,
"b": 37.097,
"c": 68.532,
"alpha": 90.000,
"beta": 101.306,
"gamma": 90.000
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.101,1.80],
"number_observations_unique": 12637,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.07
},
{
"type": "R(meas)",
"value": 0.083
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 11.8
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.99
}
]
},
"refln_shells": [
{
"resolution_limits": [1.84,1.80],
"number_observations_unique": 761,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.167
},
{
"type": "R(meas)",
"value": 1.374
},
{
"type": "R(pim)",
"value": 0.719
},
{
"type": "I/SigI",
"value": 1.4
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.603
}
]
}
]
}