3KUP

crystal structure of the cbx3 chromo shadow domain

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 48
  • Norm. En. per Res.: -3.3095
• 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	-11.4186	0.0	-136.714	-148.1326	47	2	6	5567	0	10	10
A-C	0.0	0.0	-0.0188	-0.0188	2	0	0	6	0	0	0
B-C	-12.0987	1.8723	-53.1312	-63.3575	48	4	3	2812	0	25	19
C-D	-16.4967	-20.2414	-122.116	-158.8541	48	4	7	5000	2	10	10

Interface residues

• A-B: ALA129A, ALA129B, ALA153A, ALA153B, ALA156A, ALA156B, ALA166A, ALA166B, ARG171A, ARG171B, ASN157A, ASN157B, ASP131A, ASP131B, CYS160A, CYS160B, GLN162A, GLN162B, GLU155A, GLU169A, GLU169B, GLU170A, ILE163A, ILE163B, ILE165A, ILE165B, LEU136A, LEU136B, LEU172A, LEU172B, LYS154A, LYS154B, LYS159A, LYS159B, MET158A, MET158B, PHE138A, PHE138B, PHE167A, PHE167B, PRO161A, PRO161B, THR173B, TYR168A, TYR168B, VAL164A, VAL164B
• A-C: ASP146C, GLN162A
• B-C: ALA118B, ALA129C, ALA148C, ALA153B, ALA156B, ARG115B, ARG115C, ARG119B, ARG119C, ARG125C, ARG171C, ASN157B, ASP112C, ASP131C, ASP146C, ASP149C, CYS160B, GLU124C, GLU135B, GLU135C, GLU147C, GLU155B, GLY116B, GLY120B, GLY128C, ILE126C, ILE127C, LEU139C, LEU150C, LEU152B, LYS113B, LYS113C, LYS141C, LYS143C, LYS154B, LYS159B, MET137B, MET137C, MET140C, MET158B, PHE117B, PHE167C, PRO114B, PRO161B, SER145C, THR130C, TRP142C, VAL151B
• C-D: ALA129C, ALA129D, ALA153C, ALA153D, ALA156C, ALA156D, ALA166C, ALA166D, ARG171C, ARG171D, ASN157C, ASN157D, ASP131C, CYS160C, CYS160D, GLN162C, GLN162D, GLU155D, GLU169C, GLU169D, GLU170C, GLU170D, ILE163C, ILE163D, ILE165C, ILE165D, LEU136C, LEU136D, LEU172C, LEU172D, LYS154C, LYS154D, LYS159C, LYS159D, MET158C, MET158D, PHE138C, PHE138D, PHE167C, PHE167D, PRO161C, PRO161D, THR130C, THR173D, TYR168C, TYR168D, VAL164C, VAL164D