Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "89c2af41f19980d025d93fae210703ca",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 58.484,
"b": 46.429,
"c": 63.247,
"alpha": 90.00,
"beta": 112.03,
"gamma": 90.00
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [96.59,2.32],
"number_observations": 79552,
"number_observations_unique": 21067,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.576
},
{
"type": "R(meas)",
"value": 0.674
},
{
"type": "R(pim)",
"value": 0.338
},
{
"type": "I/SigI",
"value": 2.6
},
{
"type": "Completeness",
"value": 92.0
},
{
"type": "Redundancy",
"value": 3.8
},
{
"type": "CC(1/2)",
"value": 0.880
}
]
},
"refln_shells": [
{
"resolution_limits": [2.44,2.32],
"number_observations": 5481,
"number_observations_unique": 2416,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.494
},
{
"type": "R(meas)",
"value": 3.087
},
{
"type": "R(pim)",
"value": 1.782
},
{
"type": "I/SigI",
"value": 0.4
},
{
"type": "Redundancy",
"value": 2.3
},
{
"type": "CC(1/2)",
"value": 0.503
}
]
}
]
}