• Engineered LRRK2 kinase-domain inhibitor scaffold 20m ago
  • Huntingtin polyQ-tract recognizer 20m ago
  • TDP-43 N-terminal stabilizer 20m ago
  • α-Synuclein aggregation inhibitor 20m ago
  • Anti-Aβ42 binder de novo 20m ago

Details

sequence
MSLSRAAAQALWLWGGVAAELQTFKGPCDKKLSAERLAGGQQNGTLGLGNLTLWDPAEQLLNDLQHFMGVWKDIQLTQSSESVALRRSRSRAIVFQGLHFTVVTFQDKGLRSVTYQSVALQPDEYQGLTCYEDSPSAQKASQEAPMPNQTNTMASSPWSLVDLTHKVEEALNLISSQSIQEQLKQSNMGTMHFLSYQISSLNR186K_D87N_T96I
target_protein
phospholipid membrane
score
0.87
method
RoseTTAFold + Bayesian optimization + MD simulation
Raw fields (1)
metadata
{
  "method": "RoseTTAFold + Bayesian optimization + MD simulation",
  "_origin": {
    "url": null,
    "type": "internal",
    "tracked_at": "2026-04-16T11:11:49.523003"
  },
  "sequence": "MSLSRAAAQALWLWGGVAAELQTFKGPCDKKLSAERLAGGQQNGTLGLGNLTLWDPAEQLLNDLQHFMGVWKDIQLTQSSESVALRRSRSRAIVFQGLHFTVVTFQDKGLRSVTYQSVALQPDEYQGLTCYEDSPSAQKASQEAPMPNQTNTMASSPWSLVDLTHKVEEALNLISSQSIQEQLKQSNMGTMHFLSYQISSLNR186K_D87N_T96I",
  "mutations": [
    "R186K",
    "D87N",
    "T96I"
  ],
  "uniprot_id": "Q9NZC2",
  "binding_affinity": {
    "Kd_nM": 120,
    "target": "phospholipid membrane",
    "improvement_fold": 3.75
  },
  "predicted_stability": -47.8
}

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