3T1I

crystal structure of human mre11: understanding tumorigenic mutations

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-D
  • Int. Res.: 18
  • Norm. En. per Res.: -2.737
• Hub Node: A(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
A-B	-5.3608	-3.6596	523.548	514.5277	89	11	5	5875	1	24	19
A-C	0.0	0.0	-0.0256	-0.0256	6	0	0	12	0	5	5
A-D	-11.7107	-25.0783	-12.4768	-49.2658	18	3	0	634	1	12	17
B-C	0.0	-11.127	-11.0713	-22.1983	22	0	0	796	0	23	18
C-D	-5.9444	6.5903	672.152	672.7978	106	21	7	8028	0	24	22

Interface residues

• A-B: ALA135A, ALA135B, ALA137A, ALA137B, ALA147A, ALA147B, ARG155A, ARG155B, ARG188A, ARG188B, ARG191A, ARG191B, ARG69A, ASN151A, ASN151B, ASP136A, ASP136B, ASP142A, ASP142B, ASP96A, ASP96B, CYS139A, CYS139B, CYS146A, CYS146B, GLN97A, GLN97B, GLU160A, GLU160B, GLY134A, GLY134B, GLY148A, GLY148B, GLY154A, GLY154B, GLY180A, GLY180B, GLY182A, GLY182B, HIS126A, HIS126B, HIS152A, HIS152B, ILE125A, ILE125B, ILE143A, ILE143B, ILE162A, ILE184A, ILE184B, LEU138A, LEU138B, LEU141A, LEU141B, LYS66A, LYS66B, PHE123A, PHE123B, PHE153A, PHE153B, PRO132A, PRO132B, PRO166A, PRO166B, PRO185A, PRO185B, PRO67B, SER124A, SER124B, SER145A, SER145B, SER156A, SER156B, SER158A, SER158B, SER165A, SER165B, SER95A, SER95B, SER98B, THR133A, THR133B, VAL150A, VAL150B, VAL159A, VAL159B, VAL167A, VAL167B, VAL99B
• A-C: ASP96C, GLU205C, GLU92A, GLY172A, PRO88A, SER95C
• A-D: ALA30D, ARG69D, ARG87A, ASN117A, ASP86A, GLN48A, GLU27D, GLU49A, GLU51A, GLY85A, HIS73D, LEU116A, LYS28D, LYS66D, LYS70D, PRO67D, SER68D, THR71D
• B-C: ARG69B, ARG80B, ARG87C, ASN115C, ASN11C, ASP86C, ASP8C, ASP9C, GLN90C, GLU10C, GLU27B, GLU51C, GLU77B, GLY172C, HIS73B, LEU116B, LYS28B, LYS70B, PRO88C, SER68B, THR71B, VAL89C
• C-D: ALA135C, ALA135D, ALA137C, ALA137D, ALA140C, ALA147C, ALA147D, ARG155C, ARG155D, ARG188C, ARG188D, ARG191C, ARG191D, ARG69C, ARG80C, ASN100D, ASN151C, ASN151D, ASP136C, ASP136D, ASP142C, ASP142D, ASP96C, ASP96D, CYS139C, CYS139D, CYS146C, CYS146D, GLN97C, GLN97D, GLU160C, GLU160D, GLY102D, GLY134C, GLY134D, GLY148C, GLY148D, GLY154C, GLY154D, GLY180D, GLY182D, HIS126C, HIS126D, HIS152C, HIS152D, HIS73C, ILE125C, ILE125D, ILE143C, ILE143D, ILE162C, ILE184C, ILE184D, ILE93C, LEU138C, LEU138D, LEU141C, LEU141D, LEU144C, LEU144D, LEU72C, LEU76C, LYS105D, LYS66C, LYS66D, PHE101D, PHE103D, PHE106D, PHE123C, PHE123D, PHE149C, PHE153C, PHE153D, PRO107D, PRO132C, PRO132D, PRO166C, PRO166D, PRO185C, PRO185D, PRO67C, SER104D, SER124C, SER124D, SER145C, SER145D, SER156C, SER156D, SER158C, SER158D, SER165C, SER165D, SER68C, SER95C, SER95D, SER98C, SER98D, THR133C, THR133D, VAL150C, VAL150D, VAL159C, VAL159D, VAL167C, VAL167D, VAL99D