2025-08-30_00000264
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ligand
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9MK5
Crystal structure of Neisseria meningitidis ClpP protease complex with small molecule activator, Dioctatin;
X-ray diffraction 1.90Å
Protein #1
218 residues (86% resolved)
Raw Sequence ...
HHHHHHENLYFQSNMSFDNYLVPTVIEQSGRGERAFDIYSRLLKERIVFLVGPVTDESANLVVAQLLFLESENPDKDIFFYINSPGGSVTAGMSIYDTMNFIKPDVSTLCLGQAASMGAFLLSAGEKGKRFALPNSRIMIHQPLISGGLGGQASDIEIHARELLKIKEKLNRLMAKHCDRDLADLERDTDRDNFMSAEEAKEYGLIDQILENRASLRL
Canonical Sequence ...
HHHHHHENLYFQSNMSFDNYLVPTVIEQSGRGERAFDIYSRLLKERIVFLVGPVTDESANLVVAQLLFLESENPDKDIFFYINSPGGSVTAGMSIYDTMNFIKPDVSTLCLGQAASMGAFLLSAGEKGKRFALPNSRIMIHQPLISGGLGGQASDIEIHARELLKIKEKLNRLMAKHCDRDLADLERDTDRDNFMSAEEAKEYGLIDQILENRASLRL
Non polymer #2
A1BMH
InChI=1S/C18H35N3O4/c1-3-5-7-9-14(19)11-17(23)21-15(10-8-6-4-2)12-16(22)20-13-18(24)25/h14-15H,3-13,19H2,1-2H3,(H,20,22)(H,21,23)(H,24,25)/t14-,15-/m0/s1
InChI=1S/C18H35N3O4/c1-3-5-7-9-14(19)11-17(23)21-15(10-8-6-4-2)12-16(22)20-13-18(24)25/h14-15H,3-13,19H2,1-2H3,(H,20,22)(H,21,23)(H,24,25)/t14-,15-/m0/s1
SMILES: CCCCC[C@@H](CC(=O)N[C@@H](CCCCC)CC(=O)NCC(=O)O)N
CCCCC[C@@H](CC(=O)N[C@@H](CCCCC)CC(=O)NCC(=O)O)N
Biounit #1
homo-14-mer
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Model
Reference
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