2025-02-22_00000219
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ligand
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7HZC
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-0036397-001 (A71EV2A-x4537);
X-ray diffraction 1.39Å
Protein #1
144 residues (97% resolved)
Raw Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Canonical Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Non polymer #2
A1BN8
InChI=1S/C15H16N2O2S/c16-15(19)10-5-6-14(18)17(7-10)8-11-9-20-13-4-2-1-3-12(11)13/h1-4,9-10H,5-8H2,(H2,16,19)/t10-/m0/s1
InChI=1S/C15H16N2O2S/c16-15(19)10-5-6-14(18)17(7-10)8-11-9-20-13-4-2-1-3-12(11)13/h1-4,9-10H,5-8H2,(H2,16,19)/t10-/m0/s1
SMILES: c1ccc2c(c1)c(cs2)CN3C[C@H](CCC3=O)C(=O)N
c1ccc2c(c1)c(cs2)CN3C[C@H](CCC3=O)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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