Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b2d06022d435b39c170d222965c365f5",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 84.766,
"b": 43.450,
"c": 51.026,
"alpha": 90.000,
"beta": 123.217,
"gamma": 90.000
},
"wavelengths": [0.97940],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [21.32,1.48],
"number_observations_unique": 25043,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "R(meas)",
"value": 0.091
},
{
"type": "R(pim)",
"value": 0.032
},
{
"type": "I/SigI",
"value": 20.56
},
{
"type": "Completeness",
"value": 95.90
},
{
"type": "Redundancy",
"value": 8.1
},
{
"type": "CC(1/2)",
"value": 1
}
]
},
"refln_shells": [
{
"resolution_limits": [1.53,1.48],
"number_observations_unique": 2391,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.66
},
{
"type": "R(meas)",
"value": 0.72
},
{
"type": "R(pim)",
"value": 0.26
},
{
"type": "I/SigI",
"value": 3.24
},
{
"type": "CC(1/2)",
"value": 0.87
}
]
}
]
}