Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "43112dd50b257965453248241c9c65f6",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 169.165,
"b": 80.602,
"c": 79.307,
"alpha": 90.000,
"beta": 92.218,
"gamma": 90.000
},
"wavelengths": [0.87000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [79.25,2.00],
"number_observations_unique": 71422,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.08
},
{
"type": "R(meas)",
"value": 0.09
},
{
"type": "R(pim)",
"value": 0.05
},
{
"type": "I/SigI",
"value": 9.3
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.99
}
]
},
"refln_shells": [
{
"resolution_limits": [2.07,2.00],
"number_observations_unique": 4614,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.49
},
{
"type": "R(meas)",
"value": 0.58
},
{
"type": "R(pim)",
"value": 0.30
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "CC(1/2)",
"value": 0.81
}
]
}
]
}