2025-03-29_00000145
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ligand
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7I69
Group deposition of Coxsackievirus A16 (G-10) 2A protease in complex with inhibitors from the ASAP AViDD centre -- Crystal structure of Coxsackievirus A16 (G-10) 2A protease in complex with ASAP-0037646-001 (A71EV2A-x4934);
X-ray diffraction 1.32Å
Protein #1
144 residues (97% resolved)
Raw Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Canonical Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Non polymer #2
A1B4E
InChI=1S/C18H19N3O2/c19-18(23)15-7-8-17(22)21(12-15)11-14-4-1-2-6-16(14)13-5-3-9-20-10-13/h1-6,9-10,15H,7-8,11-12H2,(H2,19,23)/t15-/m0/s1
InChI=1S/C18H19N3O2/c19-18(23)15-7-8-17(22)21(12-15)11-14-4-1-2-6-16(14)13-5-3-9-20-10-13/h1-6,9-10,15H,7-8,11-12H2,(H2,19,23)/t15-/m0/s1
SMILES: c1ccc(c(c1)CN2C[C@H](CCC2=O)C(=O)N)c3cccnc3
c1ccc(c(c1)CN2C[C@H](CCC2=O)C(=O)N)c3cccnc3
Non polymer #3
ZN
InChI=1S/Zn/q+2
InChI=1S/Zn/q+2
SMILES: [Zn+2]
[Zn+2]
Biounit #1
monomer
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Model
Reference
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