Table 2. Binding energy values of... | Rockefeller University Press

Table 2.

Binding energy values of residues interacting with ADPR in the NUDT9-H domain

Residues	VDW	Electrostatic	Polar solvation	Nonpolar solvation	Total
	kcal/mol	kcal/mol	kcal/mol	kcal/mol	kcal/mol
HIS1346	−1.40	−1.60	2.10	−0.23	−1.13
THR1347	−0.55	−6.53	0.23	−0.06	−6.91
TYR1349	−1.85	−2.99	2.94	−0.11	−2.01
LEU1379	−1.04	0.11	−0.49	−0.17	−1.60
GLY1389	−0.99	−3.22	1.01	−0.20	−3.40
SER1391	−0.14	0.27	−0.03	−7.32E-05	0.10
GLU1409	−0.09	1.08	−0.73	−0.01	0.26
ASP1431	−0.67	−3.14	3.98	−0.13	0.04
ARG1433	−1.17	0.30	0.72	−0.30	−0.45
LEU1484	−0.04	−0.10	−0.05	0.00	−0.18
HIS1488	−2.07	−1.16	0.93	−0.20	−2.51

Residues	VDW	Electrostatic	Polar solvation	Nonpolar solvation	Total
	kcal/mol	kcal/mol	kcal/mol	kcal/mol	kcal/mol
HIS1346	−1.40	−1.60	2.10	−0.23	−1.13
THR1347	−0.55	−6.53	0.23	−0.06	−6.91
TYR1349	−1.85	−2.99	2.94	−0.11	−2.01
LEU1379	−1.04	0.11	−0.49	−0.17	−1.60
GLY1389	−0.99	−3.22	1.01	−0.20	−3.40
SER1391	−0.14	0.27	−0.03	−7.32E-05	0.10
GLU1409	−0.09	1.08	−0.73	−0.01	0.26
ASP1431	−0.67	−3.14	3.98	−0.13	0.04
ARG1433	−1.17	0.30	0.72	−0.30	−0.45
LEU1484	−0.04	−0.10	−0.05	0.00	−0.18
HIS1488	−2.07	−1.16	0.93	−0.20	−2.51