Title:Graphene oxide enriched with oxygen-containing groups: on the way to an increase of antioxidant activity and biocompatibility
DOI:10.1016/j.colsurfb.2021.112232
ligand name:graphene oxide
ligand smiles:O=C(O)C1=CC2=C3C(=O)OC4(O)C3=C3C5=C2C2C1=CC(O)C1=C6C=CC7=CC(C(=O)O)=C8C(=O)C9C(O)=C%10C%11=C%12C%13C%14C%15C%16%17OC%16%18C%16=C%19C(=C(C(=O)O)C(O)C%20C(=O)C%21=C(C(=O)O)C4C4%22OC34C3C4=C%23C%22C%21(O)C(C%19%20)C%18(O)C%23C%15%18OC%18%15C4C4=C%18C3(O)C5=C(C12O)C12OC%181C(=C9C4=C%10C%13%15O)C8C7C62)CC(O)=C%16C1=CC(C(=O)O)=C2CC(O)C3(OC%143C2(O)C1%17)C%12(O)OC%11=O
key residue(hbond):
key residue(hydrophobic):
PDB ID:
Binding Area:

#Binding and thermodynamic parameters#
parameter;C_GO=0.025-0.040g/l;C_GO=0.005-0.025g/l;
pH;
T;298.15;298.15;
KSV;
kq;
n;1.39;1.12;
K;
Ka;
Kb;263.0268;58.8844;
ΔH;
ΔS;
ΔG;
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)





