Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c5763a562013f87df45be35fa8dd3b6c",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 48.440,
"b": 65.391,
"c": 81.877,
"alpha": 90.00,
"beta": 91.51,
"gamma": 90.00
},
"wavelengths": [0.97625],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [81.85,1.59],
"number_observations_unique": 57157,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.05
},
{
"type": "R(pim)",
"value": 0.05
},
{
"type": "I/SigI",
"value": 12.3
},
{
"type": "Completeness",
"value": 83
},
{
"type": "Redundancy",
"value": 4.0
},
{
"type": "CC(1/2)",
"value": 1.00
}
]
},
"refln_shells": [
{
"resolution_limits": [1.62,1.59],
"number_observations_unique": 3245,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.46
},
{
"type": "R(pim)",
"value": 0.40
},
{
"type": "I/SigI",
"value": 2.7
},
{
"type": "CC(1/2)",
"value": 0.85
}
]
}
]
}