2025-03-29_00000138
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ligand
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7I62
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-0036702-001 (A71EV2A-x4908);
X-ray diffraction 1.65Å
Protein #1
144 residues (97% resolved)
Raw Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Canonical Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Non polymer #2
A1B4L
InChI=1S/C16H18N2O3/c17-16(20)13-5-2-7-18(10-13)14(19)9-12-4-1-3-11-6-8-21-15(11)12/h1,3-4,6,8,13H,2,5,7,9-10H2,(H2,17,20)/t13-/m0/s1
InChI=1S/C16H18N2O3/c17-16(20)13-5-2-7-18(10-13)14(19)9-12-4-1-3-11-6-8-21-15(11)12/h1,3-4,6,8,13H,2,5,7,9-10H2,(H2,17,20)/t13-/m0/s1
SMILES: c1cc2ccoc2c(c1)CC(=O)N3CCC[C@@H](C3)C(=O)N
c1cc2ccoc2c(c1)CC(=O)N3CCC[C@@H](C3)C(=O)N
Non polymer #3
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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