Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9139085b80a516b278372af83e1621a4",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.681,
"b": 61.692,
"c": 32.763,
"alpha": 90.00,
"beta": 92.93,
"gamma": 90.00
},
"wavelengths": [0.92203],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.01,1.92],
"number_observations": 77391,
"number_observations_unique": 11112,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.355
},
{
"type": "R(meas)",
"value": 0.383
},
{
"type": "R(pim)",
"value": 0.144
},
{
"type": "I/SigI",
"value": 3.7
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.977
}
]
},
"refln_shells": [
{
"resolution_limits": [1.96,1.92],
"number_observations": 5280,
"number_observations_unique": 731,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.290
},
{
"type": "R(meas)",
"value": 2.466
},
{
"type": "R(pim)",
"value": 0.910
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Redundancy",
"value": 7.2
},
{
"type": "CC(1/2)",
"value": 0.296
}
]
}
]
}