Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "255e3f32835269ec14b157f1b9d2afeb",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 44.916,
"b": 119.798,
"c": 52.810,
"alpha": 90.00,
"beta": 90.56,
"gamma": 90.00
},
"wavelengths": [0.96600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.91,2],
"number_observations_unique": 36844,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.121
},
{
"type": "R(meas)",
"value": 0.168
},
{
"type": "R(pim)",
"value": 0.117
},
{
"type": "I/SigI",
"value": 6.8
},
{
"type": "Completeness",
"value": 97.74
},
{
"type": "Redundancy",
"value": 1.5
},
{
"type": "CC(1/2)",
"value": 0.951
}
]
},
"refln_shells": [
{
"resolution_limits": [2.072,2.0],
"number_observations_unique": 3709,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.742
},
{
"type": "R(meas)",
"value": 1.022
},
{
"type": "R(pim)",
"value": 0.699
},
{
"type": "Completeness",
"value": 98.85
},
{
"type": "CC(1/2)",
"value": 0.384
}
]
}
]
}