2025-02-22_00000215
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ligand
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7HZ8
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-0036342-001 (A71EV2A-x4509);
X-ray diffraction 1.53Å
Protein #1
144 residues (97% resolved)
Raw Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Canonical Sequence ...
SGAIYVGNYRVVNRHLATHNDWANLVWEDSSRDLLVSSTTAQGCDTIARCDCQTGVYYCSSRRKHYPVSFSKPSLIFVEASEYYPARYQSHLMLAVGHSEPGDCGGILRCQHGVVGIVSTGGNGLVGFADVRDLLWLDEEAMEQ
Non polymer #2
A1BQS
InChI=1S/C14H18FN3O2/c1-9(11-5-12(15)7-17-6-11)14(20)18-4-2-3-10(8-18)13(16)19/h5-7,9-10H,2-4,8H2,1H3,(H2,16,19)/t9-,10+/m1/s1
InChI=1S/C14H18FN3O2/c1-9(11-5-12(15)7-17-6-11)14(20)18-4-2-3-10(8-18)13(16)19/h5-7,9-10H,2-4,8H2,1H3,(H2,16,19)/t9-,10+/m1/s1
SMILES: C[C@@H](c1cc(cnc1)F)C(=O)N2CCC[C@@H](C2)C(=O)N
C[C@@H](c1cc(cnc1)F)C(=O)N2CCC[C@@H](C2)C(=O)N
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
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Model
Reference
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