2025-06-28_00000085|ligand|9FQY

Pseudomonas aeruginosa Elastase in complex with a phosphonate based inhibitor (R-configured); X-ray diffraction 1.60Å
Protein #1 301 residues (99% resolved)

AEAGGPGGNQKIGKYTYGSDYGPLIVNDRCEMDDGNVITVDMNSSTDDSKTTPFRFACPTNTYKQVNGAYSPLNDAHFFGGVVFKLYRDWFGTSPLTHKLYMKVHYGRSVENAYWDGTAMLFGDGATMFYPLVSLDVAAHEVSHGFTEQNSGLIYRGQSGGMNEAFSDMAGEAAEFYMRGKNDFLIGYDIKKGSGALRYMDQPSRDGRSIDNASQYYNGIDVHHSSGVYNRAFYLLANSPGWDTRKAFEVFVDANRYYWTATSNYNSGACGVIRSAQNRNYSAADVTRAFSTVGVTCPSAL

AEAGGPGGNQKIGKYTYGSDYGPLIVNDRCEMDDGNVITVDMNSSTDDSKTTPFRFACPTNTYKQVNGAYSPLNDAHFFGGVVFKLYRDWFGTSPLTHKLYMKVHYGRSVENAYWDGTAMLFGDGATMFYPLVSLDVAAHEVSHGFTEQNSGLIYRGQSGGMNEAFSDMAGEAAEFYMRGKNDFLIGYDIKKGSGALRYMDQPSRDGRSIDNASQYYNGIDVHHSSGVYNRAFYLLANSPGWDTRKAFEVFVDANRYYWTATSNYNSGACGVIRSAQNRNYSAADVTRAFSTVGVTCPSAL
Non polymer #2 A1IFN

InChI=1S/C19H26F3N2O6P/c1-10(2)9-14(31(28,29)30)17(26)24-15(11(3)4)18(27)23-13-7-5-12(6-8-13)16(25)19(20,21)22/h5-8,10-11,14-15H,9H2,1-4H3,(H,23,27)(H,24,26)(H2,28,29,30)/t14-,15+/m1/s1

CC(C)C[C@H](C(=O)N[C@@H](C(C)C)C(=O)Nc1ccc(cc1)C(=O)C(F)(F)F)P(=O)(O)O
Non polymer #3 CA

InChI=1S/Ca/q+2

[Ca+2]
Non polymer #4 ZN

InChI=1S/Zn/q+2

[Zn+2]
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Reference