2025-02-22_00000155
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ligand
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7HXK
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-0035311-001 (A71EV2A-x4295);
X-ray diffraction 1.22Å
Protein #1
144 residues (97% resolved)
Raw Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Canonical Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Non polymer #2
A1BQP
InChI=1S/C14H18N2O4/c1-20-12-5-3-2-4-10(12)11(17)8-16-7-9(14(15)19)6-13(16)18/h2-5,9,11,17H,6-8H2,1H3,(H2,15,19)/t9-,11-/m0/s1
InChI=1S/C14H18N2O4/c1-20-12-5-3-2-4-10(12)11(17)8-16-7-9(14(15)19)6-13(16)18/h2-5,9,11,17H,6-8H2,1H3,(H2,15,19)/t9-,11-/m0/s1
SMILES: COc1ccccc1[C@H](CN2C[C@H](CC2=O)C(=O)N)O
COc1ccccc1[C@H](CN2C[C@H](CC2=O)C(=O)N)O
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
Download coordinates
Biounit #2
monomer
Download coordinates
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Model
Reference
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