2025-02-22_00000088
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ligand
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7HVM
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-0032584-001 (A71EV2A-x3564);
X-ray diffraction 1.38Å
Protein #1
144 residues (97% resolved)
Raw Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Canonical Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Non polymer #2
A1BN5
InChI=1S/C14H13N3O2/c1-9-4-2-3-5-12(9)17-14(19)11-6-10(13(15)18)7-16-8-11/h2-8H,1H3,(H2,15,18)(H,17,19)
InChI=1S/C14H13N3O2/c1-9-4-2-3-5-12(9)17-14(19)11-6-10(13(15)18)7-16-8-11/h2-8H,1H3,(H2,15,18)(H,17,19)
SMILES: Cc1ccccc1NC(=O)c2cc(cnc2)C(=O)N
Cc1ccccc1NC(=O)c2cc(cnc2)C(=O)N
Non polymer #3
DMS
InChI=1S/C2H6OS/c1-4(2)3/h1-2H3
InChI=1S/C2H6OS/c1-4(2)3/h1-2H3
SMILES: CS(=O)C
CS(=O)C
Non polymer #4
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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