2025-02-22_00000094
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ligand
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7HVT
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-0032067-002 (A71EV2A-x3593);
X-ray diffraction 1.16Å
Protein #1
144 residues (97% resolved)
Raw Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Canonical Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Non polymer #2
A1BP1
InChI=1S/C15H16N4O2/c1-10(7-11-8-21-9-16-11)17-15(20)14-12-5-3-4-6-13(12)19(2)18-14/h3-6,8-10H,7H2,1-2H3,(H,17,20)
InChI=1S/C15H16N4O2/c1-10(7-11-8-21-9-16-11)17-15(20)14-12-5-3-4-6-13(12)19(2)18-14/h3-6,8-10H,7H2,1-2H3,(H,17,20)
SMILES: C[C@@H](Cc1cocn1)NC(=O)c2c3ccccc3n(n2)C
C[C@@H](Cc1cocn1)NC(=O)c2c3ccccc3n(n2)C
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
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Model
Reference
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