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Electronic Supplementary Information
Self-assembling mini cell-penetrating peptides enter by both direct translocation and
glycosaminoglycan-dependent endocytosis
S. A. Bode, M. Thévenin, C. Bechara, S. Sagan, S. Bregant, S. Lavielle, G. Chassaing, F. Burlina
Abbreviations
Boc, tert-butoxycarbonyl; BSA, bovine serum albumin; CHCA, α-cyano-4-hydroxycinnamic acid; CHO cells, Chinese
hamster ovary cells; CPP, cell-penetrating peptide; DAPI, 4’,6-diamidino-2-phenylindole; DCC,
dicyclohexylcarbodiimide; DLS, Dynamic light scattering, DMEM, Dulbecco's modified Eagle medium; DIEA,
diisopropylethylamine; DMF, N,N-dimethylformamide; DTT, dithiotreitol; FBS, fetal bovine serum; EDTA,
ethylenediamine tetraacetic acid; Fmoc, 9-fluorenylmethoxycarbonyl; HBTU, 2-(1H-benzotriazole-1-yl)-1,1,3,3-
tetramethyluronium hexafluorophosphate; HCTU, O-(1H-6-chlorobenzotriazole-1-yl)-1,1,3,3-tetramethyluronium
hexafluorophosphate, HOBt, 1-hydroxybenzotriazole;
1
H-PKCi, non deuterated PKCi;
2
H-PKCi, deuterated PKCi;
HPLC, high performance liquid chromatography; MALDI-TOF MS, matrix-assisted laser desorption/ionization time-
of-flight mass spectrometry; MBHA-PS, 4-methylbenzhydrylamine polystyrene; Npys, 3-nitro-2-pyridinesulphenyl;
PBS, phosphate buffered saline; PKCi, protein kinase C inhibitor; rt, room temperature; SEM, standard error of the
mean; TCEP, tris(2-carboxyethyl)phosphine; TFA, trifluoroacetic acid.
Reagents
Coupling reagents for peptide synthesis and protected amino acids were purchased from Novabiochem (Merck
Chemicals Ltd) except for (2,2-D
2
, 98%)-Boc Glycine, which was obtained from Euriso-top. Solvents for peptide
synthesis and TFA were obtained from SDS. Tris-HCl, Triton X-100, trypsin inhibitor and bovine serum albumin were
obtained from Sigma-Aldrich. Dulbecco’s modified Eagle medium, fetal bovine serum, trypsin-EDTA (0.05 % trypsin,
0.02 % EDTA) and Hank’s BSS were purchased from PAA. The cell counting kit (CCK8) was from Dojindo
Laboratories. Streptavidin-coated magnetic beads (Dynabeads® MyOne™ Streptavidin C1 or Dynabeads® M-280
Streptavidin) were purchased from Invitrogen. The complete mini tablets of protease inhibitors were from Roche. DAPI
was from Pierce.
Peptide synthesis
Cysteamino-Merrifield resin
Merrifield resin (0.5 g, loading 1.09 mmol/g) was swollen in DMF. Cysteamine hydrochloride
(0.186 g, 5.45 mmol) was added to an ice-cooled suspension of NaH 60 % in mineral oil (0.218 g,
5.45 mmol) in dry DMF (1.5 mL). The resulting mixture was stirred at rt until the generation of
hydrogen gas stopped (about 20 min) and then added to the Merrifield resin in DMF. The mixture
was shaken for 48 h at rt or heated at 50 °C under micro-waves (10 x 5 seconds, 60 W). The resin
was washed with CH
2
Cl
2
, CH
3
OH, H
2
O and CH
2
Cl
2
and dried under vacuum.
Synthesis of CPPs C4 to C18
Amounts of reagent are given in equivalents (eq.) with respect to the peptidyl-resin.
CPPs were synthesised manually on the cysteamino-Merrifield resin (0.2 g, 0.218 mmol) using the
Boc strategy. Boc-Arg(Tos)-OH (3 eq.) was activated by 5 min treatment with HBTU (2.9 eq.),
HOBt (3 eq.) and DIEA (6 eq.) in DMF (final amino acid concentration: 0.45 M). Each coupling
was performed by 5 shots of 5 s of micro-waves (50 °C, 60 W). Between each shot, the resin was
cooled in liquid nitrogen. The reaction was monitored by the Kaiser test and double couplings were
performed if necessary. The Boc protecting group was removed by treatment with TFA (3 x 1 min)
followed by neutralisation with DIEA (20 % in DMF). Coupling of the carbon chains was
performed using either the chloride derivative (3 eq.) (lauroyl chloride for C12, myristoyl chloride
for C14) or the carboxylic acid derivative (3 eq.) (palmitic acid for C16, stearic acid for C18) with
HBTU/DIEA activation. Reactions were performed under micro-waves (5 x 5 s, 50 °C, 60 W).
Peptide cleavage from the resin was performed by treatment with HF (2 h, 0 °C) in presence of
anisole (1.5 mL/g peptidyl-resin), dimethylsulfide (0.25 mL/g peptidyl-resin) and p-toluenethiol
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This journal is © The Royal Society of Chemistry 2012