Title:Study on the binding of novel antitumor drug Ethaselen to bovine serum albumin
DOI:None
ligand name:Ethaselen
ligand smiles:C1=CC=C2C(=C1)C(=O)N([Se]2)CCN3C(=O)C4=CC=CC=C4[Se]3
key residue(hbond):
key residue(hydrophobic):
PDB ID:
Binding Area:

#Binding and thermodynamic parameters#
parameter;
pH;
T;296;303;310;
KSV;9.20*10^4;9.01*10^4;8.47*10^4;
kq;9.20*10^12;9.01*10^12;8.47*10^12;
n;0.82;0.88;0.97;
K;
Ka;
Kb;1.5*10^4;2.7*10^4;6.2*10^4;
ΔH;78.5;78.5;78.5;
ΔS;344.1;344.1;344.1;
ΔG;-23.3536;-25.7623;-28.1710;
Kd;


#ITC#
parameter;
pH;
T;
n;
K;
Ka;
Kb;
ΔH;
ΔS;
ΔG;
Cp;
Kd;

#UV-vis absorption spectroscopy#
parameter;
pH;
T;
n;
K;
Ka;
Kb;
ΔH;
ΔS;
ΔG;
Kd;

#other_method#
method;
parameter;
pH;
T;
n;
K;
Ka;
Kb;
ΔH;
ΔS;
ΔG;
Kd;

#Kinetic Parameters Describing Michaelis–Menten Constant#
HSA/Ligand;RA (%);Vmax;Km;kcat;kcat/Km;



#FRET from Steady State Measurements#
parameter;
pH;
T;
J;
E;
R0;
r;
EFRET;
F0;
F;

#Changes in the ASA(Å2) Values of the Interacting Residues of HSA and ligand Complex
residues;ASA(Å2) of HSA;ASA(Å2)of com;ΔASA(Å2)





