Reaction Details  Report a problem with these data
Cell Reactant:
Trypsin
Syringe Reactant:
BDBM773
Meas. Tech.:
Isothermal Titration Calorimetry
Entry Date.:
06/15/04
ΔG°:
-6.6±0.02 (kcal/mole)
pH:
8±n/a
Log10Kb:
3.5
Temperature:
298.25±n/a (K)
ΔH° :
-4.43±0.07 (kJ/mole)
ΔHobs :
-4.43±0.07 (kJ/mole)
Corrected for ΔHioniz:
not known
ΔS° :
0.01±0 (kJ/mole-K)
Comments:
Data taken from Talhout, R.; Engberts, J. B. F. N. Eur. J. Biochem. 2001, 268, 1554-1560.
Citation
 Talhout, R; Villa, A; Mark, AE; Engberts, JB Understanding binding affinity: a combined isothermal titration calorimetry/molecular dynamics study of the binding of a series of hydrophobically modified benzamidinium chloride inhibitors to trypsin. J Am Chem Soc 125:10570-9 (2003) [PubMed]  Article
Cell React
Source:
no
Name:
Serine protease 1
Synonyms:
Beta-Trypsin | Cationic trypsin | PRSS1 | TRP1 | TRY1 | TRY1_BOVIN | TRYP1 | Trypsin | Trypsin I
Type:
Enzyme
Mol. Mass.:
25790.52
Organism:
Bos taurus (bovine)
Description:
P00760
Residue:
246
Sequence:
MKTFIFLALLGAAVAFPVDDDDKIVGGYTCGANTVPYQVSLNSGYHFCGGSLINSQWVVSAAHCYKSGIQVRLGEDNINVVEGNEQFISASKSIVHPSYNSNTLNNDIMLIKLKSAASLNSRVASISLPTSCASAGTQCLISGWGNTKSSGTSYPDVLKCLKAPILSDSSCKSAYPGQITSNMFCAGYLEGGKDSCQGDSGGPVVCSGKLQGIVSWGSGCAQKNKPGVYTKVCNYVSWIKQTIASN
  
Syringe React
Source:
Synthesized
Name:
BDBM773
Synonyms:
[amino(4-methylphenyl)methylidene]azanium | benzamidine deriv. | p-methylbenzamidinium chloride
Type:
Small organic molecule
Emp. Form.:
C8H11N2
Mol. Mass.:
135.1858
SMILES:
Cc1ccc(cc1)C(N)=[NH2+]
Structure:
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