2024-05-11_00000300
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ligand
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8WGU
Crystal structure of V30M-TTR in complex with compound 20;
X-ray diffraction 1.51Å
Protein #1
159 residues (72% resolved)
Raw Sequence ...
MRGSHHHHHHGSMASHRLLLLCLAGLVFVSEAGPTGTGESKCPLMVKVLDAVRGSPAINVAMHVFRKAADDTWEPFASGKTSESGELHGLTTEEEFVEGIYKVEIDTKSYWKALGISPFHEHAEVVFTANDSGPRRYTIAALLSPYSYSTTAVVTNPKE
Canonical Sequence ...
MRGSHHHHHHGSMASHRLLLLCLAGLVFVSEAGPTGTGESKCPLMVKVLDAVRGSPAINVAMHVFRKAADDTWEPFASGKTSESGELHGLTTEEEFVEGIYKVEIDTKSYWKALGISPFHEHAEVVFTANDSGPRRYTIAALLSPYSYSTTAVVTNPKE
Non polymer #2
WH0
InChI=1S/C17H10F2I2O3/c1-2-12-14(13-8(18)3-4-9(19)17(13)24-12)15(22)7-5-10(20)16(23)11(21)6-7/h3-6,23H,2H2,1H3
InChI=1S/C17H10F2I2O3/c1-2-12-14(13-8(18)3-4-9(19)17(13)24-12)15(22)7-5-10(20)16(23)11(21)6-7/h3-6,23H,2H2,1H3
SMILES: CCc1c(c2c(ccc(c2o1)F)F)C(=O)c3cc(c(c(c3)I)O)I
CCc1c(c2c(ccc(c2o1)F)F)C(=O)c3cc(c(c(c3)I)O)I
Biounit #1
homo-tetramer
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Model
Reference
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