2026-07-18_00000200
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ligand
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9RY5
Transthyretin bivalent stabiliser complex;
X-ray diffraction 1.24Å
Protein #1
127 residues (92% resolved)
Raw Sequence ...
GPTGTGESKCPLMVKVLDAVRGSPAINVAVHVFRKAADDTWEPFASGKTSESGELHGLTTEEEFVEGIYKVEIDTKSYWKALGISPFHEHAEVVFTANDSGPRRYTIAALLSPYSYSTTAVVTNPKE
Canonical Sequence ...
GPTGTGESKCPLMVKVLDAVRGSPAINVAVHVFRKAADDTWEPFASGKTSESGELHGLTTEEEFVEGIYKVEIDTKSYWKALGISPFHEHAEVVFTANDSGPRRYTIAALLSPYSYSTTAVVTNPKE
Non polymer #2
A1JKR
InChI=1S/C34H35Cl2N3O7/c35-27-21-23(37-29-9-3-1-7-25(29)33(41)42)11-13-31(27)45-19-5-15-39(17-18-40)16-6-20-46-32-14-12-24(22-28(32)36)38-30-10-4-2-8-26(30)34(43)44/h1-4,7-14,21-22,37-38,40H,5-6,15-20H2,(H,41,42)(H,43,44)
InChI=1S/C34H35Cl2N3O7/c35-27-21-23(37-29-9-3-1-7-25(29)33(41)42)11-13-31(27)45-19-5-15-39(17-18-40)16-6-20-46-32-14-12-24(22-28(32)36)38-30-10-4-2-8-26(30)34(43)44/h1-4,7-14,21-22,37-38,40H,5-6,15-20H2,(H,41,42)(H,43,44)
SMILES: c1ccc(c(c1)C(=O)O)Nc2ccc(c(c2)Cl)OCCCN(CCCOc3ccc(cc3Cl)Nc4ccccc4C(=O)O)CCO
c1ccc(c(c1)C(=O)O)Nc2ccc(c(c2)Cl)OCCCN(CCCOc3ccc(cc3Cl)Nc4ccccc4C(=O)O)CCO
Biounit #1
homo-dimer
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Model
Reference
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