3DS4

hiv-1 capsid c-terminal domain mutant (l211s) in complex with an inhibitor of particle assembly (cai)

• Total interactions analyzed: 3
• Total true interactions: 2
• Strongest Interaction:
  • Chains: A-T
  • Int. Res.: 55
  • Norm. En. per Res.: -4.4668
• 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	0.0	29.5922	-115.623	-86.0307	50	2	5	4954	0	5	7
A-T	-37.2351	11.4154	-219.853	-245.6727	55	9	3	7541	0	7	13

Interface residues

• A-B: ALA177A, ALA177B, ARG154B, ASN183A, ASN183B, ASN193A, ASN193B, ASP152A, ASP152B, GLN176A, GLN176B, GLN179A, GLN179B, GLN192A, GLN192B, GLU175A, GLU175B, GLU180A, GLU180B, GLU187A, ILE150A, ILE150B, LEU151A, LEU151B, LEU172A, LEU172B, LEU189A, LEU189B, LEU190B, LYS182A, LYS182B, LYS203B, MET185A, MET185B, PHE168A, PHE168B, PRO207B, SER149A, SER149B, SER178A, SER178B, THR148A, THR186A, THR186B, THR188A, THR188B, TRP184A, TRP184B, VAL181A, VAL181B
• A-T: ALA174A, ALA177A, ALA209A, ARG162A, ARG167A, ARG173A, ASN183A, ASP163A, ASP166A, ASP5T, ASP8T, GLN179A, GLU175A, GLU180A, GLU187A, GLU212A, GLU213A, GLU4T, GLY11T, GLY206A, GLY208A, ILE150A, ILE1T, LEU172A, LEU190A, LEU202A, LEU205A, LEU6T, LEU7T, LYS170A, LYS182A, MET185A, MET214A, MET215A, PHE161A, PHE168A, PHE3T, PRO12T, PRO207A, SER178A, SER211A, THR171A, THR186A, THR188A, THR210A, THR216A, THR2T, TRP184A, TYR10T, TYR164A, TYR169A, TYR9T, VAL165A, VAL181A, VAL191A