Structural approach of the mechanism of inhibition of alpha-chymotrypsin by coumarins.
A pharmacophore associated to the inhibiton of alpha-chymotrypsin has been built based on the structural and electronic characterization of a series of coumarin derivatives.
Wouters
Johan
J
Laboratoire de Chimie Moléculaire Structurale, Facultés Universitaires N.-D. de la Paix, 61 rue de Bruxelles, B-5000 Namur, Belgium.
Huygens
Marjorie
M
Pochet
Lionel
L
Pirotte
Bernard
B
Durant
François
F
Masereel
Bernard
B
D000925:Anticoagulants / Q000494:pharmacology*; D001665:Binding Sites; D002918:Chymotrypsin / Q000037:antagonists & inhibitors*; D003374:Coumarins / Q000494:pharmacology*; D003460:Crystallization; D018360:Crystallography, X-Ray; D008958:Models, Molecular; D008961:Models, Structural
D000925:Anticoagulants; D003374:Coumarins; D002918:Chymotrypsin; C117608:alpha-chymotrypsin