2025-02-22_00000160
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ligand
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7HXP
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-0035420-001 (A71EV2A-x4308);
X-ray diffraction 1.68Å
Protein #1
144 residues (97% resolved)
Raw Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Canonical Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Non polymer #2
A1BS6
InChI=1S/C14H16ClN3O4/c15-9-4-11-12(22-7-21-11)5-10(9)17-14(20)18-3-1-2-8(6-18)13(16)19/h4-5,8H,1-3,6-7H2,(H2,16,19)(H,17,20)/t8-/m0/s1
InChI=1S/C14H16ClN3O4/c15-9-4-11-12(22-7-21-11)5-10(9)17-14(20)18-3-1-2-8(6-18)13(16)19/h4-5,8H,1-3,6-7H2,(H2,16,19)(H,17,20)/t8-/m0/s1
SMILES: c1c(c(cc2c1OCO2)Cl)NC(=O)N3CCC[C@@H](C3)C(=O)N
c1c(c(cc2c1OCO2)Cl)NC(=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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