6Q21

molecular switch for signal transduction: structural differences between active and inactive forms of protooncogenic ras proteins

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 64
  • Norm. En. per Res.: -3.0156
• Hub Node: A(2)

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	-39.8709	-65.5635	-87.5669	-193.0012	64	23	0	4913	7	18	24
A-C	-17.1291	16.0549	-59.2357	-60.3099	48	2	0	3037	0	14	15
B-D	-18.2437	-3.3784	-81.12	-102.742	53	11	0	3730	0	14	17
C-D	-24.5049	11.8772	-93.4628	-106.0906	53	4	0	3806	0	16	22

Interface residues

• A-B: ALA130B, ALA134B, ALA155B, ARG128B, ARG135B, ARG161B, ARG164A, ARG164B, ARG169B, ARG41A, ASP132B, ASP154B, ASP47A, ASP47B, ASP54A, CYS51A, GLN131B, GLN165A, GLN165B, GLN43A, GLU143B, GLU162B, GLU3A, GLU49A, GLY138B, GLY48A, HIS166B, ILE139B, ILE142B, ILE163A, ILE163B, ILE46A, ILE46B, ILE55A, LEU113B, LEU133B, LEU159B, LEU168A, LEU171A, LEU171B, LEU52A, LEU53A, LYS167A, LYS170B, LYS42A, LYS5A, MET111B, MET1A, PRO110B, PRO140B, SER127B, SER136B, SER39A, THR158B, THR2A, THR50A, TYR141B, TYR157B, TYR40A, TYR4A, VAL112B, VAL160A, VAL44A, VAL45A
• A-C: ALA134A, ARG135A, ARG161A, ARG164A, ARG41C, ASP132A, ASP154A, ASP47A, ASP47C, ASP54C, CYS51C, GLN131A, GLN165A, GLN43C, GLU143A, GLU162A, GLU3C, GLU49C, GLY138A, GLY48C, HIS166A, ILE139A, ILE142A, ILE163A, ILE24C, ILE46A, ILE46C, LEU113A, LEU159A, LEU168A, LEU171A, LEU171C, LEU52C, LYS42C, MET111A, MET1C, PRO140A, SER39C, THR158A, THR2C, THR50C, TYR137A, TYR141A, TYR157A, TYR40C, VAL112A, VAL44C, VAL45C
• B-D: ALA130D, ALA134D, ARG135D, ARG161D, ARG164B, ARG164D, ARG169D, ARG41B, ASP108D, ASP132D, ASP154D, ASP47B, ASP47D, ASP54B, CYS51B, GLN131D, GLN165D, GLN43B, GLU143D, GLU162D, GLU3B, GLU49B, GLY138D, GLY48B, HIS166D, ILE139D, ILE142D, ILE163D, ILE24B, ILE46B, ILE46D, LEU113D, LEU159D, LEU52B, LEU53B, LYS42B, MET111D, MET1B, PRO110D, PRO140D, SER136D, SER39B, THR158D, THR2B, THR50B, TYR137D, TYR141D, TYR157D, TYR40B, TYR4B, VAL112D, VAL44B, VAL45B
• C-D: ALA134C, ALA155C, ARG128C, ARG135C, ARG161C, ARG164C, ARG169C, ARG41D, ASP108C, ASP132C, ASP154C, ASP47C, ASP47D, ASP54D, CYS51D, GLN131C, GLN165C, GLN43D, GLU143C, GLU162C, GLU3D, GLU49D, GLY138C, GLY48D, HIS166C, ILE139C, ILE142C, ILE163C, ILE46C, ILE46D, LEU113C, LEU159C, LEU168C, LEU52D, LEU53D, LYS167D, LYS42D, MET111C, MET1D, PRO110C, PRO140C, SER136C, THR158C, THR2D, THR50D, TYR137C, TYR141C, TYR157C, TYR4D, VAL112C, VAL160C, VAL44D, VAL45D