2025-03-29_00000088
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ligand
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7I4O
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-0036659-001 (A71EV2A-x4724);
X-ray diffraction 1.62Å
Protein #1
144 residues (97% resolved)
Raw Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Canonical Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Non polymer #2
A1B24
InChI=1S/C15H18F2N2O2S/c1-22-12-5-3-2-4-10(12)8-13(20)19-7-6-15(16,17)11(9-19)14(18)21/h2-5,11H,6-9H2,1H3,(H2,18,21)/t11-/m0/s1
InChI=1S/C15H18F2N2O2S/c1-22-12-5-3-2-4-10(12)8-13(20)19-7-6-15(16,17)11(9-19)14(18)21/h2-5,11H,6-9H2,1H3,(H2,18,21)/t11-/m0/s1
SMILES: CSc1ccccc1CC(=O)N2CCC([C@@H](C2)C(=O)N)(F)F
CSc1ccccc1CC(=O)N2CCC([C@@H](C2)C(=O)N)(F)F
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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