NOBBLE

Neosubstrate and Oligopeptide Binder Benchmarking for Ligase Engagement

running
jobs
83/100
pairs
6/6 br
RMSD
12.308
valid
1/3
Pinned E3 none GLUE none TARGET none PEPTIDE none

Pose

The predicted ternary in 3D. Receptor as cartoon, peptide as a tube coloured by per-residue pLDDT, ligand as ball-and-stick. Controls reuse BINMAN's viewer idiom.

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Nothing to show for this pair yet.

Presentation is BINMAN's, unchanged: the AlphaFold four-band pLDDT scale, a translucent gaussian surface over the polymer, and the ligand as sticks inside an emissive shell so it reads through the surface. The per-seed geometry below is the text alternative: every number the viewer can show is in the table.

Per-seed geometry

JobComplexConditioningSeed ipTM (receptor-peptide)ipTM (global) pLDDTAffinity
bench06_RBM39_DCAF15__binary__unconstrained__seed1 binary unconstrained 1 0.7961 0.9048 0.894 —
bench06_RBM39_DCAF15__binary__unconstrained__seed2 binary unconstrained 2 0.7980 0.9035 0.893 —
bench06_RBM39_DCAF15__binary__unconstrained__seed3 binary unconstrained 3 0.8713 0.8992 0.894 —
bench06_RBM39_DCAF15__binary__unconstrained__seed4 binary unconstrained 4 0.7232 0.8935 0.890 —
bench06_RBM39_DCAF15__binary__unconstrained__seed5 binary unconstrained 5 0.8415 0.9078 0.893 —
bench06_RBM39_DCAF15__ternary__conditioned__seed1 ternary conditioned 1 0.9135 0.9412 0.907 1.159
bench06_RBM39_DCAF15__ternary__conditioned__seed2 ternary conditioned 2 0.9172 0.9422 0.905 1.221
bench06_RBM39_DCAF15__ternary__conditioned__seed3 ternary conditioned 3 0.9124 0.9400 0.905 1.225
bench06_RBM39_DCAF15__ternary__conditioned__seed4 ternary conditioned 4 0.9081 0.9341 0.905 1.210
bench06_RBM39_DCAF15__ternary__conditioned__seed5 ternary conditioned 5 0.9179 0.9401 0.907 1.146
bench06_RBM39_DCAF15__ternary__unconstrained__seed1 ternary unconstrained 1 0.9145 0.9407 0.907 1.398
bench06_RBM39_DCAF15__ternary__unconstrained__seed2 ternary unconstrained 2 0.9202 0.9440 0.905 1.341
bench06_RBM39_DCAF15__ternary__unconstrained__seed3 ternary unconstrained 3 0.9205 0.9390 0.904 1.324

Affinity is recorded for the small-molecule chain only and is never a ranking key (spec 4.7). There is no protein-protein affinity path in Boltz-2, so no peptide affinity is reported anywhere in this application.