Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "4aaba6948f1ae7aeafe9a293b988668d",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 79.117,
"b": 47.055,
"c": 82.785,
"alpha": 90.00,
"beta": 111.18,
"gamma": 90.00
},
"wavelengths": [0.61990],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [73.84,1.70],
"number_observations_unique": 62922,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.149
},
{
"type": "R(meas)",
"value": 0.161
},
{
"type": "R(pim)",
"value": 0.061
},
{
"type": "I/SigI",
"value": 5.3
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.73,1.70],
"number_observations_unique": 3133,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.788
},
{
"type": "R(meas)",
"value": 1.934
},
{
"type": "R(pim)",
"value": 0.730
},
{
"type": "I/SigI",
"value": 0.2
},
{
"type": "CC(1/2)",
"value": 0.603
}
]
}
]
}