1P7H

structure of nfat1 bound as a dimer to the hiv-1 ltr kb element

• Total interactions analyzed: 28
• Total true interactions: 5
• Strongest Interaction:
  • Chains: N-O
  • Int. Res.: 77
  • Norm. En. per Res.: -2.75
• Hub Node: L(3)

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
L-M	-25.589	-37.3011	-145.257	-208.1471	77	19	1	6326	4	26	23
L-N	0.0	-6.2112	-2.985	-9.1962	40	0	0	563	0	28	16
L-O	0.0	0.0	-0.059	-0.059	6	0	0	32	0	0	3
M-N	0.0	0.0	-0.0592	-0.0592	6	0	0	32	0	0	3
N-O	-23.3547	-37.4254	-150.971	-211.7511	77	18	1	6311	4	24	23

Interface residues

• L-M: ALA524L, ALA524M, ARG522L, ARG522M, ARG529L, ARG582L, ARG665M, ARG667L, ARG667M, ASN523L, ASN523M, ASN602L, ASN636L, ASN657M, ASP525L, ASP525M, ASP584L, ASP586L, ASP617M, GLN583L, GLN583M, GLN601L, GLN619M, GLN620M, GLN634L, GLN669L, GLN669M, GLN671L, GLN671M, GLU527L, GLU527M, GLU576L, GLU581L, GLU581M, GLU613M, GLY600L, GLY618M, HIS672L, HIS672M, ILE597L, ILE621M, LEU528M, LEU577L, LEU577M, LEU598L, LEU638L, LYS614M, LYS655M, LYS666L, LYS666M, MET579L, MET579M, MET637L, PHE603L, PHE639L, PHE658L, PHE658M, PHE673M, PRO578L, PRO578M, PRO670L, PRO670M, SER668L, SER668M, THR585L, THR599L, THR612M, THR615M, THR616M, TYR659L, TYR659M, VAL580L, VAL580M, VAL654M, VAL656M, VAL660L, VAL660M
• L-N: GLU606L, GLU606N, GLU625L, GLU625N, GLU641L, GLU641N, GLU644L, GLU644N, GLY438L, GLY438N, GLY439L, GLY439N, GLY481L, GLY481N, HIS477L, HIS477N, LYS482L, LYS482N, LYS491L, LYS491N, LYS608L, LYS608N, MET624L, MET624N, THR437L, THR437N, THR480L, THR480N, THR483L, THR483N, THR486L, THR486N, THR627L, THR627N, TYR489L, TYR489N, VAL484L, VAL484N, VAL628L, VAL628N
• L-O: ARG651L, ASN647L, GLN619L, HIS649L, ILE535O, LYS530O
• M-N: ARG651N, ASN647N, GLN619N, HIS649N, ILE535M, LYS530M
• N-O: ALA524N, ALA524O, ARG522N, ARG522O, ARG529N, ARG582N, ARG665O, ARG667N, ARG667O, ASN523N, ASN523O, ASN602N, ASN636N, ASN657O, ASP525N, ASP525O, ASP584N, ASP586N, ASP617O, GLN583N, GLN583O, GLN601N, GLN619O, GLN620O, GLN634N, GLN669N, GLN669O, GLN671N, GLN671O, GLU527N, GLU527O, GLU576N, GLU581N, GLU581O, GLU613O, GLY600N, GLY618O, HIS672N, HIS672O, ILE597N, ILE621O, LEU528O, LEU577N, LEU577O, LEU598N, LEU638N, LYS614O, LYS655O, LYS666N, LYS666O, MET579N, MET579O, MET637N, PHE603N, PHE639N, PHE658N, PHE658O, PHE673O, PRO578N, PRO578O, PRO670N, PRO670O, SER668N, SER668O, THR585N, THR599N, THR612O, THR615O, THR616O, TYR659N, TYR659O, VAL580N, VAL580O, VAL654O, VAL656O, VAL660N, VAL660O