Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2dce6e9b8c40f0b888b31d68c6babd0a",
"space_group_name": "P 2 21 21",
"unit_cell": {
"a": 39.520,
"b": 92.598,
"c": 139.976,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.66,2.14],
"number_observations_unique": 29133,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.099
},
{
"type": "R(meas)",
"value": 0.111
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 9.0
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 4.5
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.20,2.14],
"number_observations_unique": 2281,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.969
},
{
"type": "R(meas)",
"value": 1.091
},
{
"type": "R(pim)",
"value": 0.490
},
{
"type": "CC(1/2)",
"value": 0.667
}
]
}
]
}