Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "89a3962ad77ef8983a144cdbbf5ae743",
"space_group_name": "I 21 21 21",
"unit_cell": {
"a": 49.46,
"b": 70.06,
"c": 84.78,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.39,2.52],
"number_observations": 37758,
"number_observations_unique": 5217,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "R(meas)",
"value": 0.084
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 13.7
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.59,2.52],
"number_observations": 2482,
"number_observations_unique": 367,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.392
},
{
"type": "R(meas)",
"value": 2.589
},
{
"type": "R(pim)",
"value": 0.975
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.300
}
]
}
]
}