2025-02-22_00000089
|
ligand
|
7HVN
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-0032666-001 (A71EV2A-x3568);
X-ray diffraction 1.38Å
Protein #1
144 residues (97% resolved)
Raw Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Canonical Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Non polymer #2
A1BPJ
InChI=1S/C15H15N3O2/c1-10-2-3-12-13(7-17-14(12)6-10)15(19)16-5-4-11-8-20-9-18-11/h2-3,6-9,17H,4-5H2,1H3,(H,16,19)
InChI=1S/C15H15N3O2/c1-10-2-3-12-13(7-17-14(12)6-10)15(19)16-5-4-11-8-20-9-18-11/h2-3,6-9,17H,4-5H2,1H3,(H,16,19)
SMILES: Cc1ccc2c(c1)[nH]cc2C(=O)NCCc3cocn3
Cc1ccc2c(c1)[nH]cc2C(=O)NCCc3cocn3
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
Tube
Model
Reference
100%