1RGU

the crystal structure of human tyrosyl-dna phosphodiesterase complexed with vanadate, octopamine, and tetranucleotide agtg

• Total interactions analyzed: 6
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 78
  • Norm. En. per Res.: -1.7591
• Hub Node: A(1)

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	-13.4039	-9.001	-114.807	-137.2119	78	5	0	5120	1	24	25

Interface residues

• A-B: ALA321A, ALA321B, ALA547A, ALA547B, ALA568A, ASN162A, ASN162B, ASN351A, ASN351B, ASP346A, ASP346B, ASP381A, ASP381B, GLU314A, GLU314B, GLU349A, GLU349B, GLY308B, GLY313A, GLY313B, GLY549A, GLY549B, HIS310A, HIS310B, HIS318A, HIS318B, HIS343A, HIS343B, HIS382A, HIS382B, ILE305A, ILE305B, LEU544A, LEU544B, LEU548A, LEU548B, LEU550A, LEU550B, LYS311A, LYS311B, LYS320A, LYS320B, LYS377A, LYS377B, LYS380A, LYS380B, PHE164A, PHE164B, PHE319A, PHE319B, PHE553A, PHE553B, PRO163A, PRO163B, PRO300A, PRO316A, PRO316B, PRO545A, PRO545B, SER312A, SER312B, SER315A, SER315B, SER348A, SER348B, SER365A, SER365B, SER546A, SER546B, THR309A, THR309B, THR317A, THR317B, THR350A, THR569A, THR569B, TYR353A, TYR353B