3LG7

crystal structure of hiv epitope-scaffold 4e10_s0_1ez3a_002_c

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 64
  • Norm. En. per Res.: -3.4506
• 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	-19.9926	-30.5053	-170.338	-220.8359	64	3	5	6629	2	12	8
A-C	0.0	0.0	-98.7879	-98.7879	53	2	2	4163	0	9	4
B-C	-13.0656	-15.7057	-154.248	-183.0193	68	4	6	6381	1	13	10

Interface residues

• A-B: ALA120B, ALA35A, ALA38B, ALA55A, ALA55B, ARG117B, ARG119B, ARG121B, ARG123B, ARG21A, ASN124B, ASN25A, ASN41A, ASN41B, ASN43A, ASN43B, ASN62B, ASP115B, ASP46A, ASP46B, ASP56A, ASP56B, GLN113B, GLN114B, GLN32A, GLN49A, GLU126B, GLU59A, GLU59B, HIS33B, ILE36A, ILE36B, ILE47A, ILE47B, ILE57B, LEU125B, LEU37B, LEU50A, LEU50B, LEU51A, LEU51B, LEU53A, LEU53B, LYS118B, LYS122B, LYS58B, MET54A, MET54B, PHE45A, PRO40A, PRO40B, PRO42A, PRO42B, SER39A, SER39B, SER48A, SER48B, THR60A, TRP44A, TRP44B, TRP52A, TRP52B, TYR109B, TYR116B
• A-C: ALA120A, ALA55A, ALA55C, ALA61A, ARG117A, ARG121A, ARG21C, ARG65A, ASN124A, ASN124C, ASN41C, ASN43A, ASN43C, ASN62A, ASP46C, ASP56A, ASP56C, GLN113A, GLN114A, GLN49C, GLU59A, GLU59C, GLU63A, HIS33A, ILE36A, ILE36C, ILE47A, ILE47C, ILE57A, LEU37A, LEU50A, LEU50C, LEU51A, LEU51C, LEU53A, LEU53C, LYS58A, LYS66A, MET54A, PHE45C, PRO40C, PRO42A, PRO42C, SER48A, SER48C, THR60A, TRP44A, TRP44C, TRP52A, TRP52C, TYR109A, TYR116A, VAL29A
• B-C: ALA120C, ALA35B, ALA38C, ALA55B, ALA55C, ARG117C, ARG119C, ARG121C, ARG123C, ARG21B, ASN124C, ASN25B, ASN41B, ASN41C, ASN43B, ASN62C, ASP115C, ASP46B, ASP46C, ASP56B, ASP56C, GLN113C, GLN114C, GLN32B, GLN32C, GLN49B, GLU126C, GLU59B, GLU59C, GLU63B, HIS33C, ILE36B, ILE36C, ILE47B, ILE47C, ILE57B, ILE57C, LEU125C, LEU37C, LEU50B, LEU50C, LEU51B, LEU51C, LEU53B, LEU53C, LYS118C, LYS122C, LYS58B, LYS58C, MET54B, MET54C, PHE45B, PRO40B, PRO40C, PRO42B, PRO42C, SER39B, SER39C, SER48B, SER48C, THR60B, TRP44B, TRP44C, TRP52B, TRP52C, TYR109C, TYR116C, TYR18B