Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b050ede51be8e53078924724fa52bf15",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 74.592,
"b": 46.577,
"c": 133.996,
"alpha": 90.00,
"beta": 104.76,
"gamma": 90.00
},
"wavelengths": [0.97600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [72.13,2.029],
"number_observations_unique": 57629,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.06373
},
{
"type": "R(pim)",
"value": 0.04039
},
{
"type": "I/SigI",
"value": 12.48
},
{
"type": "Completeness",
"value": 98.29
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.102,2.029],
"number_observations_unique": 5601,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.5658
},
{
"type": "R(pim)",
"value": 0.3561
},
{
"type": "Completeness",
"value": 97.95
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.703
}
]
}
]
}