3IUR

appep_d266nx+h2h3 opened state

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 26
  • Norm. En. per Res.: -3.5985
• 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	-21.984	-25.322	-79.3175	-126.6235	44	7	0	3105	2	6	5
A-C	-17.2263	0.0	-76.3349	-93.5612	26	11	2	2440	0	0	0
B-C	0.0	0.0	-6.741	-6.741	7	1	0	182	0	0	0

Interface residues

• A-B: ALA279A, ALA299A, ALA497A, ALA57B, ARG297A, ARG302A, ARG324A, ARG55B, ASN256A, ASN296A, ASN301A, ASP278A, ASP280A, ASP298A, ASP462A, GLN274A, GLN325A, GLN326A, GLN496A, GLU323A, GLU493A, GLY255A, GLY491A, GLY492A, GLY495A, HIS499A, LEU277A, LEU328A, LEU500A, MET53B, PHE461A, PHE58B, PRO300A, SER254A, SER464A, SER56B, THR253A, THR295A, THR54B, TRP498A, TYR494A, TYR581A, VAL327A, VAL463A
• A-C: ALA299A, ALA497A, ARG302A, ARG303A, ARG324A, ASN301A, ASP298A, ASP462A, GLN325A, GLN326A, GLN496A, GLU323A, GLY492A, GLY495A, HIS499A, LEU500A, LEU61C, LEU63C, LYS65C, PRO300A, PRO322A, PRO62C, TRP498A, TRP64C, TYR494A, VAL327A
• B-C: ARG55B, LEU63C, LYS65C, MET53B, PHE58B, THR54B, TRP64C