3MJR

human dck complex with acyclic nucleoside

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 98
  • Norm. En. per Res.: -2.8065
• 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	-9.0158	-16.455	-249.568	-275.0388	98	16	2	11026	5	20	7
A-C	0.0	0.0	-7.3996	-7.3996	12	1	0	346	0	6	9
B-C	0.0	0.0	-0.0016	-0.0016	2	0	0	1	0	0	1
B-D	0.0	0.0	-7.931	-7.931	14	1	0	395	0	10	9
C-D	-18.913	9.5144	-147.162	-156.5606	88	11	2	7492	2	18	9

Interface residues

• A-B: ALA100A, ALA100B, ALA110B, ARG106A, ARG106B, ARG91A, ARG91B, ASN148A, ASN148B, ASN164A, ASN164B, ASN77A, ASN77B, ASN80A, ASN80B, ASP157A, ASP157B, ASP160A, ASP160B, GLN156A, GLN156B, GLN165A, GLN165B, GLN168B, GLN75B, GLN97A, GLU149A, GLU149B, GLU151A, GLU151B, GLU90A, GLU90B, GLY78A, GLY78B, GLY79A, GLY79B, HIS159A, HIS159B, ILE105A, ILE105B, ILE154A, ILE154B, LEU102A, LEU102B, LEU109A, LEU109B, LEU82A, LEU82B, LYS76A, LYS76B, LYS88A, LYS88B, MET147A, MET147B, MET162A, MET162B, MET73A, MET84A, MET84B, PHE166A, PHE166B, PHE94A, PHE94B, PHE96A, PHE96B, PRO89A, PRO89B, SER103A, SER103B, SER146A, SER146B, SER74A, SER93A, SER93B, THR150A, THR150B, THR153A, THR153B, THR95A, THR95B, THR98A, THR98B, TRP152A, TRP152B, TRP158A, TRP158B, TRP161A, TRP161B, TRP58A, TRP58B, TRP92A, TRP92B, TYR155A, TYR155B, TYR99A, TYR99B, VAL81A, VAL81B
• A-C: ALA119A, ARG219C, ASN113A, ASP118A, GLN229C, GLY114A, HIS218C, LEU116A, LYS115A, LYS117A, LYS222C, THR220C
• B-C: ASN164C, ASP226B
• B-D: ALA119D, ARG219B, ASN113D, ASP118D, GLN229B, GLY114D, HIS218B, LEU116D, LEU221B, LYS115D, LYS117D, LYS222B, SER214B, THR220B
• C-D: ALA100C, ALA100D, ARG106C, ARG106D, ARG91C, ARG91D, ASN148C, ASN148D, ASN163C, ASN163D, ASN164C, ASN164D, ASN77C, ASN77D, ASN80C, ASN80D, ASP157C, ASP157D, ASP160D, GLN156D, GLN165C, GLN165D, GLN75C, GLN97C, GLU149C, GLU149D, GLU151C, GLU151D, GLU90C, GLU90D, GLY78C, GLY78D, GLY79C, GLY79D, HIS159C, HIS159D, ILE105C, ILE154C, ILE154D, LEU102C, LEU102D, LEU109C, LEU109D, LEU82C, LYS76C, LYS88C, MET147C, MET147D, MET162C, MET162D, MET84C, MET84D, PHE166C, PHE166D, PHE94C, PHE94D, PHE96C, PHE96D, PRO89C, PRO89D, SER103D, SER146C, SER146D, SER74C, SER93C, SER93D, THR150C, THR150D, THR153C, THR153D, THR95C, THR95D, THR98C, THR98D, TRP152D, TRP158C, TRP158D, TRP161C, TRP161D, TRP58C, TRP92C, TRP92D, TYR155C, TYR155D, TYR99C, TYR99D, VAL81C, VAL81D