2025-12-13_00000110
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medium
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9LYS
Crystal structure of de novo designed amantadine binding homotrimer dAIT03;
X-ray diffraction 2.00Å
Protein #1
57 residues (96% resolved)
Raw Sequence ...
SEDRDTARVLLIMVRSLLKIGNPEDAEEVVKMIEELARRTNDPEIRRLLEEARKLVK
Canonical Sequence ...
SEDRDTARVLLIMVRSLLKIGNPEDAEEVVKMIEELARRTNDPEIRRLLEEARKLVK
Non polymer #2
308
InChI=1S/C10H17N/c11-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6,11H2/t7-,8+,9-,10-
InChI=1S/C10H17N/c11-10-4-7-1-8(5-10)3-9(2-7)6-10/h7-9H,1-6,11H2/t7-,8+,9-,10-
SMILES: C1C2CC3CC1CC(C2)(C3)N
C1C2CC3CC1CC(C2)(C3)N
Biounit #1
homo-trimer
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Model
Reference
100%