2025-03-29_00000134
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ligand
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7I5Y
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-0036759-001 (A71EV2A-x4894);
X-ray diffraction 1.84Å
Protein #1
144 residues (97% resolved)
Raw Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Canonical Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Non polymer #2
A1B4P
InChI=1S/C15H20N2O3S/c1-21-12-6-3-2-5-11(12)9-13(18)17-8-4-7-15(20,10-17)14(16)19/h2-3,5-6,20H,4,7-10H2,1H3,(H2,16,19)/t15-/m1/s1
InChI=1S/C15H20N2O3S/c1-21-12-6-3-2-5-11(12)9-13(18)17-8-4-7-15(20,10-17)14(16)19/h2-3,5-6,20H,4,7-10H2,1H3,(H2,16,19)/t15-/m1/s1
SMILES: CSc1ccccc1CC(=O)N2CCC[C@@](C2)(C(=O)N)O
CSc1ccccc1CC(=O)N2CCC[C@@](C2)(C(=O)N)O
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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