{"ligand_smiles": "c1c(cc(c(c1I)Oc2cc(c(c(c2)I)O)I)I)C[C@@H](C(=O)O)N%%c1c(cc(c(c1I)Oc2cc(c(c(c2)I)O)I)I)C[C@@H](C(=O)O)N", "ligand_id": "T44%%T44", "ligstr": "T44:A:C15 H11 I4 N O4:776.87:3,5,3',5'-TETRAIODO-L-THYRONINE:c1c(cc(c(c1I)Oc2cc(c(c(c2)I)O)I)I)C[C@@H](C(=O)O)N:InChI=1S/C15H11I4NO4/c16-8-4-7(5-9(17)13(8)21)24-14-10(18)1-6(2-11(14)19)3-12(20)15(22)23/h1-2,4-5,12,21H,3,20H2,(H,22,23)/t12-/m0/s1:XUIIKFGFIJCVMT-LBPRGKRZSA-N;T44:B:C15 H11 I4 N O4:776.87:3,5,3',5'-TETRAIODO-L-THYRONINE:c1c(cc(c(c1I)Oc2cc(c(c(c2)I)O)I)I)C[C@@H](C(=O)O)N:InChI=1S/C15H11I4NO4/c16-8-4-7(5-9(17)13(8)21)24-14-10(18)1-6(2-11(14)19)3-12(20)15(22)23/h1-2,4-5,12,21H,3,20H2,(H,22,23)/t12-/m0/s1:XUIIKFGFIJCVMT-LBPRGKRZSA-N", "ligand_name": "3,5,3',5'-TETRAIODO-L-THYRONINE%%3,5,3',5'-TETRAIODO-L-THYRONINE", "global_stoichiometry": "Homo 2-mer -\u00c2\u00a0A2", "chain_id": "A%%B", "pmid": "11243784", "alternative_name": "ATTR, Prealbumin, TBPA", "pdb_classification": "TRANSPORT PROTEIN", "amyloid_non_amyloid": "Non-amyloid", "reference": "J Mol Biol. 2001 Mar 2;306(4):733-44", "length": "127", "inchi_key": "XUIIKFGFIJCVMT-LBPRGKRZSA-N%%XUIIKFGFIJCVMT-LBPRGKRZSA-N", "pdb_id": "1F86", "inchi": "InChI=1S/C15H11I4NO4/c16-8-4-7(5-9(17)13(8)21)24-14-10(18)1-6(2-11(14)19)3-12(20)15(22)23/h1-2,4-5,12,21H,3,20H2,(H,22,23)/t12-/m0/s1%%InChI=1S/C15H11I4NO4/c16-8-4-7(5-9(17)13(8)21)24-14-10(18)1-6(2-11(14)19)3-12(20)15(22)23/h1-2,4-5,12,21H,3,20H2,(H,22,23)/t12-/m0/s1", "type": "Protein", "gene_names": "TTR, PALB", "ligand_mw": "776.87%%776.87", "species": "Homo sapiens", "entry": "S-0028", "mutation_s_field": "T119M", "author": "Sebastiao, M.P., Lamzin, V., Saraiva, M.J., Damas, A.M.", "secondary_structure": "GPTGTGESKCPLMVKVLDAVRGSPAINVAVHVFRKAADDTWEPFASGKTSESGELHGLTTEEEFVEGIYKVEIDTKSYWKALGISPFHEHAEVVFTANDSGPRRYTIAALLSPYSYSTMAVVTNPKE#CCCCCCCCCCCEEEEEEETTTTEECCSCEEEEEEECTTSCEEEEEEEECCTTSEECCSCCTTTCCSEEEEEEECHHHHHHHTTCCCSEEEEEEEEEESTTSCCEEEEEEEEETTEEEEEEEEECCCC&GPTGTGESKCPLMVKVLDAVRGSPAINVAVHVFRKAADDTWEPFASGKTSESGELHGLTTEEEFVEGIYKVEIDTKSYWKALGISPFHEHAEVVFTANDSGPRRYTIAALLSPYSYSTMAVVTNPKE#CCCCCCCCCCCEEEEEEETTTTEECTTCEEEEEEEETTTEEEEEEEEECCTTSEECCSCCTTTCCSEEEEEEECHHHHHHHTTCCCSEEEEEEEEEECSSSCCEEEEEEEEETTEEEEEEEEECCCC", "ec_number": "", "method": "X-RAY DIFFRACTION", "r_value_free": "0.18", "uniprot_ac": "P02766", "resolution": "1.75", "description": "The main interactions between two monomers in a dimer result from H-bonds. The non-crystallographic TTR  monomers are closer in the  case  of  this  non-amyloidogenic TTR variant compared to amyloidogenic TTR Val30Met,", "peptide_protein_sequence": "chain-ID A: CPLMVKVLDAVRGSPAINVAVHVFRKAADDTWEPFASGKTSESGELHGLTTEEEFVEGIYKVEIDTKSYWKALGISPFHEHAEVVFTANDSGPRRYTIAALLSPYSYSTMAVVTN; chain-ID B: CPLMVKVLDAVRGSPAINVAVHVFRKAADDTWEPFASGKTSESGELHGLTTEEEFVEGIYKVEIDTKSYWKALGISPFHEHAEVVFTANDSGPRRYTIAALLSPYSYSTMAVVTN", "protein_name": "Transthyretin", "keyword": "Transthyretin", "remarks": "Transthyretin stability as a key factor in amyloidogenesis", "ligand_formula": "C15 H11 I4 N O4%%C15 H11 I4 N O4"}