2026-04-11_00000163
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ligand
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9QSP
Crystal structure of Zika Virus NS2B-NS3 protease in complex with Z2242050769;
X-ray diffraction 1.40Å
Protein #1
53 residues (72% resolved)
Raw Sequence ...
MTGKSVDMYIERAGDITWEKDAEVTGNSPRLDVALDESGDFSLVEEDGPPMRE
Canonical Sequence ...
MTGKSVDMYIERAGDITWEKDAEVTGNSPRLDVALDESGDFSLVEEDGPPMRE
Protein #2
176 residues (86% resolved)
Raw Sequence ...
GALWDVPAPKEVKKGETTDGVYRVMTRRLLGSTQVGVGVMQEGVFHTMWHVTKGAALRSGEGRLDPYWGDVKQDLVSYCGPWKLDAAWDGLSEVQLLAVPPGERAKNIQTLPGIFKTKDGDIGAVALDYPAGTSGSPILDKSGRVIGLYGNGVVIKNGSYVSAITQGKREEETPVE
Canonical Sequence ...
GALWDVPAPKEVKKGETTDGVYRVMTRRLLGSTQVGVGVMQEGVFHTMWHVTKGAALRSGEGRLDPYWGDVKQDLVSYCGPWKLDAAWDGLSEVQLLAVPPGERAKNIQTLPGIFKTKDGDIGAVALDYPAGTSGSPILDKSGRVIGLYGNGVVIKNGSYVSAITQGKREEETPVE
Non polymer #3
A1JAB
InChI=1S/C10H16N2/c1-10(2,3)8-12-9-6-4-5-7-11-9/h4-7H,8H2,1-3H3,(H,11,12)
InChI=1S/C10H16N2/c1-10(2,3)8-12-9-6-4-5-7-11-9/h4-7H,8H2,1-3H3,(H,11,12)
SMILES: CC(C)(C)CNc1ccccn1
CC(C)(C)CNc1ccccn1
Biounit #1
hetero-1-1-mer
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Model
Reference
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