Title:Exploration of binding studies of β-oxalyldiamino propionic acid (β-ODAP), a non-protein amino acid with human serum albumin-biophysical and computational approach
DOI:10.1080/07391102.2018.1528181
ligand name:β-oxalyldiamino propionic acid (β-ODAP)
ligand smiles:CC(=O)C(=O)N[C@H](N)C(O)=O
key residue(hbond):
key residue(hydrophobic):
PDB ID:
Binding Area:Sudlow's site I

#Binding and thermodynamic parameters#
parameter;
pH;
T;293;
KSV;
kq;5.43*10^13;
n;
K;5.09*10^4;
Ka;
Kb;
ΔH;
ΔS;
ΔG;-123.587;
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)





