2025-03-29_00000159
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ligand
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7I6N
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-0037807-001 (A71EV2A-x4992);
X-ray diffraction 1.39Å
Protein #1
144 residues (97% resolved)
Raw Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Canonical Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Non polymer #2
A1B43
InChI=1S/C13H18N4O2/c1-16-6-8(5-15-16)2-12(18)17-7-10(13(14)19)3-9-4-11(9)17/h5-6,9-11H,2-4,7H2,1H3,(H2,14,19)/t9?,10-,11+/m0/s1
InChI=1S/C13H18N4O2/c1-16-6-8(5-15-16)2-12(18)17-7-10(13(14)19)3-9-4-11(9)17/h5-6,9-11H,2-4,7H2,1H3,(H2,14,19)/t9?,10-,11+/m0/s1
SMILES: Cn1cc(cn1)CC(=O)N2C[C@H](C[C@@H]3[C@H]2C3)C(=O)N
Cn1cc(cn1)CC(=O)N2C[C@H](C[C@@H]3[C@H]2C3)C(=O)N
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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