3Q4B

clinically useful alkyl amine renin inhibitors

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 97
  • Norm. En. per Res.: -1.1684
• Hub Node: A(1)

All Interactions

Chains	Hydro. Bond Ener. (kJ/mol)	Elec. Ener. (kJ/mol)	VDW. Ener. (kJ/mol)	Tot. Stab. Ener. (kJ/mol)	#int. res.	# Short cont.	#Hydr. int.	#VDW pairs	#salt bridges	#Pot. fav. elec. int	#Pot. unfav. elec. int
A-B	0.0	10.452	-123.79	-113.338	97	3	5	7029	0	18	26

Interface residues

• A-B: ALA109A, ALA109B, ALA115A, ALA115B, ALA288A, ALA288B, ALA49A, ALA49B, ARG240A, ARG240B, ARG74A, ARG74B, ASP244A, ASP244B, ASP290A, ASP290B, GLN13B, GLU106B, GLU116A, GLU116B, GLU229A, GLU229B, GLU278B, GLU70A, GLY78A, GLY78B, HIS287A, HIS287B, HIS53B, ILE291A, LEU110A, LEU110B, LEU114A, LEU114B, LEU241A, LEU241B, LEU281A, LEU281B, LEU47A, LYS238A, LYS238B, LYS239A, LYS239B, LYS281A, LYS281B, MET10A, MET10B, MET113A, MET113B, MET289A, MET289B, PHE112A, PHE112B, PHE242A, PHE242B, PRO108A, PRO108B, PRO111A, PRO111B, PRO292A, PRO293A, PRO297A, SER222A, SER224A, SER226A, SER226B, SER279B, SER281B, SER76A, SER76B, SER81A, THR12A, THR12B, THR225A, THR225B, THR48A, THR48B, THR72A, THR72B, THR77A, THR77B, THR79A, THR79B, TYR220A, TYR220B, TYR245A, TYR245B, TYR47A, TYR52A, TYR52B, TYR75A, TYR75B, TYR9A, TYR9B, VAL246B, VAL51A, VAL51B