2025-02-22_00000172
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ligand
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7HY1
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-0035387-001 (A71EV2A-x4324);
X-ray diffraction 1.44Å
Protein #1
144 residues (97% resolved)
Raw Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Canonical Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Non polymer #2
A1BSG
InChI=1S/C15H18N2O3/c16-15(19)12-4-5-13(18)17(9-12)8-11-3-1-2-10-6-7-20-14(10)11/h1-3,12H,4-9H2,(H2,16,19)/t12-/m0/s1
InChI=1S/C15H18N2O3/c16-15(19)12-4-5-13(18)17(9-12)8-11-3-1-2-10-6-7-20-14(10)11/h1-3,12H,4-9H2,(H2,16,19)/t12-/m0/s1
SMILES: c1cc2c(c(c1)CN3C[C@H](CCC3=O)C(=O)N)OCC2
c1cc2c(c(c1)CN3C[C@H](CCC3=O)C(=O)N)OCC2
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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