3BM4

crystal structure of human adp-ribose pyrophosphatase nudt5 in complex with magnesium and ampcpr

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 238
  • Norm. En. per Res.: -4.906
• 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	-146.396	-97.8767	-923.353	-1167.6258	238	39	37	35856	11	72	60

Interface residues

• A-B: ALA124A, ALA124B, ALA129A, ALA129B, ALA187A, ALA195A, ALA195B, ALA201A, ALA201B, ALA203A, ALA203B, ALA207A, ALA207B, ALA209A, ALA209B, ALA63A, ALA63B, ALA96A, ALA96B, ARG196A, ARG196B, ARG44A, ARG44B, ARG51A, ARG51B, ARG54A, ARG54B, ARG84A, ARG84B, ASN138A, ASN138B, ASN176A, ASN176B, ASN208A, ASN208B, ASP133A, ASP133B, ASP164A, ASP164B, ASP183A, ASP183B, ASP194A, ASP194B, ASP38A, ASP38B, ASP60A, ASP60B, CYS126A, CYS126B, CYS131A, CYS131B, CYS139A, CYS139B, CYS91A, CYS91B, GLN15A, GLN15B, GLN180A, GLN69A, GLN82A, GLN82B, GLU125A, GLU125B, GLU166A, GLU166B, GLU189A, GLU189B, GLU20A, GLU20B, GLU25A, GLU25B, GLU32A, GLU32B, GLU47A, GLU47B, GLU75A, GLU75B, GLU93A, GLU93B, GLY135A, GLY135B, GLY13A, GLY13B, GLY163A, GLY163B, GLY165A, GLY165B, GLY26A, GLY26B, GLY41A, GLY88A, GLY88B, GLY89A, GLY89B, HIS142A, HIS142B, HIS190A, HIS190B, HIS206A, HIS206B, ILE141A, ILE141B, ILE143A, ILE143B, ILE17A, ILE17B, ILE18A, ILE18B, ILE23A, ILE23B, ILE65A, ILE65B, ILE77A, ILE77B, ILE92A, ILE92B, LEU136A, LEU136B, LEU178A, LEU178B, LEU179A, LEU179B, LEU182A, LEU182B, LEU191A, LEU191B, LEU202A, LEU202B, LEU204A, LEU204B, LEU22A, LEU22B, LEU31A, LEU31B, LEU98A, LEU98B, LYS14A, LYS14B, LYS175A, LYS175B, LYS205A, LYS205B, LYS27A, LYS27B, LYS30A, LYS30B, LYS33A, LYS33B, LYS42A, LYS42B, LYS50A, LYS50B, LYS81A, LYS81B, MET132A, MET132B, MET37A, MET37B, MET87A, MET87B, PHE167A, PHE167B, PHE83A, PHE83B, PHE94A, PHE94B, PRO128A, PRO128B, PRO134A, PRO134B, PRO39A, PRO39B, PRO85A, PRO85B, PRO86A, PRO86B, SER127A, SER127B, SER137A, SER137B, SER199A, SER199B, SER19B, SER24A, SER24B, SER48A, SER48B, THR140A, THR140B, THR145A, THR145B, THR192A, THR192B, THR34A, THR34B, THR35A, THR35B, THR40A, THR40B, THR45A, THR45B, THR52A, THR52B, TRP28A, TRP28B, TRP46A, TRP46B, TYR16A, TYR16B, TYR198A, TYR198B, TYR200A, TYR200B, TYR36A, TYR36B, TYR74A, TYR90A, TYR90B, VAL130A, VAL130B, VAL144A, VAL144B, VAL146A, VAL146B, VAL168A, VAL168B, VAL186A, VAL186B, VAL193A, VAL193B, VAL197A, VAL197B, VAL29A, VAL29B, VAL49A, VAL49B, VAL67A, VAL67B