2DSB

crystal structure of human adp-ribose pyrophosphatase nudt5

• Total interactions analyzed: 6
• Total true interactions: 5
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 245
  • Norm. En. per Res.: -4.7782
• 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	-137.0089	-146.0055	-887.639	-1170.6534	245	34	33	34919	11	79	66
A-D	0.0	-12.1473	-17.1164	-29.2637	28	2	0	920	1	7	2
B-C	-21.8603	9.1106	-189.118	-201.8678	66	5	7	7311	4	25	25
B-D	-27.4957	-22.0191	-70.2692	-119.784	44	2	4	2585	2	14	13
C-D	-91.6896	-61.0008	-967.94	-1120.6304	273	50	37	39214	11	87	74

Interface residues

• A-B: ALA124A, ALA124B, ALA129A, ALA129B, ALA187A, ALA187B, 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, 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, GLN69A, GLN69B, GLN82A, GLN82B, GLU125A, GLU125B, GLU166A, GLU166B, GLU169A, GLU169B, GLU20A, GLU20B, GLU213B, GLU25A, GLU25B, GLU32A, GLU32B, GLU47A, GLU47B, GLU75A, GLU75B, GLU93A, GLU93B, GLY135A, GLY135B, GLY163A, GLY163B, GLY165A, GLY165B, GLY26A, GLY26B, GLY41B, GLY88A, GLY88B, GLY89A, GLY89B, HIS142A, HIS206A, HIS206B, HIS73A, HIS73B, 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, LEU217A, LEU217B, LEU22A, LEU22B, LEU31A, LEU31B, LEU72A, LEU72B, LEU98A, LEU98B, LYS14A, LYS14B, LYS175A, LYS175B, LYS205A, LYS205B, LYS218A, LYS218B, LYS27A, LYS27B, LYS30A, LYS30B, LYS33B, LYS42A, LYS42B, LYS50A, LYS50B, LYS81A, LYS81B, MET132A, MET132B, MET37A, MET37B, MET87A, MET87B, PHE167A, PHE167B, PHE219A, PHE83A, PHE83B, PHE94A, PHE94B, PRO128A, PRO128B, PRO134A, PRO134B, PRO39A, PRO39B, PRO85A, PRO85B, PRO86A, PRO86B, SER127A, SER127B, SER137A, SER137B, SER199A, SER199B, SER19A, SER19B, SER24A, SER24B, SER48A, SER48B, THR140A, THR140B, THR145A, THR145B, THR192A, THR192B, THR34A, THR34B, THR35A, THR35B, THR40A, THR40B, THR45A, THR45B, THR52A, THR52B, THR71B, TRP28A, TRP28B, TRP46A, TRP46B, TYR16A, TYR16B, TYR198A, TYR198B, TYR200A, TYR200B, TYR36A, TYR36B, TYR90A, TYR90B, VAL130A, VAL130B, VAL144A, VAL144B, VAL146A, VAL146B, VAL168A, VAL168B, VAL186A, VAL186B, VAL193A, VAL193B, VAL197A, VAL197B, VAL214A, VAL214B, VAL29A, VAL29B, VAL49A, VAL49B, VAL67A, VAL67B
• A-D: ALA124A, ALA124D, ALA153D, ASN149D, ASN155D, ASP122A, ASP122D, ASP151D, ASP152D, CYS126A, GLN69D, GLU106A, GLU125A, GLU154D, GLY121D, ILE123A, ILE123D, ILE148D, LEU110A, LYS218A, LYS218D, PHE212A, PHE216A, PHE219A, PHE219D, PRO215A, THR147D, THR71D
• B-C: ALA184B, ALA184C, ALA187B, ALA187C, ALA209B, ALA209C, ARG181B, ARG181C, ASN176B, ASN176C, ASN208B, ASN208C, ASP177B, ASP177C, ASP183B, ASP183C, GLN180B, GLN180C, GLU169B, GLU188B, GLU188C, GLU189B, GLU189C, GLU213B, GLU213C, HIS190B, ILE171B, ILE171C, LEU173B, LEU173C, LEU178B, LEU178C, LEU179B, LEU179C, LEU182B, LEU182C, LEU185B, LEU185C, LEU191B, LEU191C, LEU202C, LEU217B, LEU217C, LYS205C, LYS210B, LYS210C, LYS218B, LYS218C, LYS81B, PHE212B, PHE212C, PHE216B, PHE216C, PHE219B, PHE219C, PRO174B, PRO174C, PRO211B, PRO211C, PRO215B, PRO215C, TYR198C, VAL186B, VAL186C, VAL214B, VAL214C
• B-D: ALA107D, ALA124D, ARG181B, ARG70B, ASN176B, ASP122D, ASP177B, ASP183B, CYS126D, GLN69D, GLU106D, GLU125D, GLU154D, GLU213B, GLU75B, GLY121D, HIS73B, ILE123D, LEU110D, LEU217B, LEU72B, LYS120D, LYS205B, LYS210B, LYS218D, PHE212B, PHE212D, PHE216B, PHE216D, PRO105D, PRO128D, PRO174B, PRO211D, PRO215D, SER127D, THR104D, THR145D, THR147D, THR71B, THR71D, TYR74B, VAL144D, VAL146D, VAL214D
• C-D: ALA124C, ALA124D, ALA129C, ALA129D, ALA184C, ALA184D, ALA187C, ALA187D, ALA195C, ALA195D, ALA201C, ALA201D, ALA203C, ALA203D, ALA207C, ALA207D, ALA209C, ALA209D, ALA59C, ALA59D, ALA63C, ALA63D, ALA96C, ALA96D, ARG196C, ARG196D, ARG44C, ARG44D, ARG51C, ARG51D, ARG54C, ARG54D, ARG70C, ARG70D, ARG84C, ARG84D, ASN138C, ASN138D, ASN176C, ASN176D, ASN208C, ASN208D, ASP133C, ASP133D, ASP164C, ASP164D, ASP177C, ASP183C, ASP183D, ASP194C, ASP194D, ASP38C, ASP38D, ASP60D, CYS126C, CYS126D, CYS131C, CYS131D, CYS139C, CYS139D, CYS76D, CYS91C, CYS91D, GLN15C, GLN15D, GLN180D, GLN69C, GLN69D, GLN82C, GLN82D, GLU125C, GLU125D, GLU166C, GLU166D, GLU169C, GLU20C, GLU20D, GLU213C, GLU213D, GLU25C, GLU25D, GLU32C, GLU32D, GLU47C, GLU47D, GLU75C, GLU75D, GLU93C, GLU93D, GLY135C, GLY135D, GLY163C, GLY163D, GLY165C, GLY165D, GLY26C, GLY26D, GLY41C, GLY41D, GLY88C, GLY88D, GLY89C, GLY89D, HIS142C, HIS142D, HIS190D, HIS206C, HIS206D, HIS73C, HIS73D, ILE141C, ILE141D, ILE143C, ILE143D, ILE17C, ILE17D, ILE18C, ILE18D, ILE23C, ILE23D, ILE65C, ILE65D, ILE77C, ILE77D, ILE92C, ILE92D, LEU136C, LEU136D, LEU178C, LEU178D, LEU179C, LEU179D, LEU182C, LEU182D, LEU185C, LEU185D, LEU191C, LEU191D, LEU202C, LEU202D, LEU204C, LEU204D, LEU217C, LEU217D, LEU22C, LEU22D, LEU31C, LEU31D, LEU72C, LEU72D, LYS14C, LYS14D, LYS175C, LYS175D, LYS205C, LYS205D, LYS210C, LYS210D, LYS218C, LYS218D, LYS27C, LYS27D, LYS30C, LYS30D, LYS33C, LYS33D, LYS42C, LYS42D, LYS50C, LYS50D, LYS81C, LYS81D, MET132C, MET132D, MET37C, MET37D, MET87C, MET87D, PHE167C, PHE167D, PHE212C, PHE212D, PHE216C, PHE216D, PHE219C, PHE219D, PHE83C, PHE83D, PHE94C, PHE94D, PRO128C, PRO128D, PRO134C, PRO134D, PRO174C, PRO211C, PRO211D, PRO215C, PRO215D, PRO39C, PRO39D, PRO85C, PRO85D, PRO86C, PRO86D, SER127C, SER127D, SER137C, SER137D, SER199C, SER199D, SER24C, SER24D, SER48C, SER48D, THR140C, THR140D, THR145C, THR145D, THR147C, THR192C, THR192D, THR34C, THR34D, THR35C, THR35D, THR40C, THR40D, THR45C, THR45D, THR52C, THR52D, THR58C, THR71C, THR71D, TRP28C, TRP28D, TRP46C, TRP46D, TYR16C, TYR16D, TYR198C, TYR198D, TYR200C, TYR200D, TYR36C, TYR36D, TYR74C, TYR74D, TYR90C, TYR90D, VAL130C, VAL130D, VAL144C, VAL144D, VAL146C, VAL146D, VAL168C, VAL168D, VAL186C, VAL186D, VAL193C, VAL193D, VAL197C, VAL197D, VAL214C, VAL214D, VAL29C, VAL29D, VAL49C, VAL49D, VAL67C, VAL67D