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. Author manuscript; available in PMC: 2017 Apr 19.
Published in final edited form as: ChemMedChem. 2015 Nov 23;11(8):919–927. doi: 10.1002/cmdc.201500441

Table 1.

List of compound sequences and summary of Kd values against YopH-NT determined by 2D NMR titrations and/or ITC.

ID Ac-Peptide sequence-NH2 Kd value (μM)
P-1 P0 P1 P2 P3 P4 P5 YopH NT by NMR YopH NT by ITC
1 D E pY D D P F nd 0.18
2 pY cPG D 17.29 6.60
3 D E pY cPG D P F nd 0.18
4 pY cPG D I 1.47 4.40
5 pY cPG D F 1.66 5.50
6 pY cPG D K 62.69 14.20
7 pY cPG D D 4.93 6.50
8 pY cPG D P nd 1.40
9 I pY cPG D 10.47 10.90
10 F pY cPG D 6.06 9.30
11 K pY cPG D 127.60 nb
12 D pY cPG D 21.67 16.20
13 I pY cPG D P nd 0.52
14 F pY cPG D P nd 0.31
15 F pY cPG W P nd 3.10

The amino acid abbreviation pY stands for phosphorylated tyrosine, cPG stands for cyclopentyl glycine. nd indicates not determined; nb indicates no binding detected at the used experimental conditions. In each peptide, the N-terminus was acetylated and the C-terminus amidated.