As a part of my master's project, I created a simple nanobody design pipeline consisting of: RFDiffusion for backbone design -> ProteinMPNN for sequence design -> Boltz-2 for structure design -> Rosetta Fast Relax -> ipSAE scoring and ranking. In this case, I created 1000 different backbones with 2 ProteinMPNN sequences each, leading to a total of almost 2000 designs. The design's originated from the 2vsm complex with mutated CDRs. Of the resulting nanobodies, I then chose the ones with the highest min_ipSAE scores obtained after a Boltz-2 structure design. The pipelines hyperparameters were tuned earlier when working with other targets (especially BCMA) in a way, to create a maximum metric discrimination between binders and non-binders. The binder design pipeline was run on an NVIDIA GeForce RTX 4090 GPU.
id: soft-owl-wave

Nipah Virus Glycoprotein G
None
80.03
True
15.8 kDa
137
id: young-swan-jade

Nipah Virus Glycoprotein G
None
78.84
True
15.6 kDa
137
id: jade-hawk-iron

Nipah Virus Glycoprotein G
None
83.89
True
15.5 kDa
137
id: violet-mole-ruby

Nipah Virus Glycoprotein G
None
78.44
True
15.7 kDa
137
id: radiant-cobra-wave

Nipah Virus Glycoprotein G
None
81.55
True
15.5 kDa
137
id: pale-swan-willow

Nipah Virus Glycoprotein G
None
81.38
True
15.6 kDa
137
id: lunar-shark-pine

Nipah Virus Glycoprotein G
None
79.95
True
15.6 kDa
137
id: hollow-gecko-plume

Nipah Virus Glycoprotein G
None
81.97
False
15.6 kDa
137
id: mellow-fox-vine

Nipah Virus Glycoprotein G
None
82.11
True
15.6 kDa
137
id: solid-vole-frost

Nipah Virus Glycoprotein G
None
78.13
True
15.7 kDa
137