3IYP

the interaction of decay-accelerating factor with echovirus 7

• Total interactions analyzed: 10
• Total true interactions: 9
• Strongest Interaction:
  • Chains: C-D
  • Int. Res.: 47
  • Norm. En. per Res.: -4.5892
• Hub Node: A(4)

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	-265.6065	-41.3819	-1165.53	-1472.5184	327	95	25	46349	13	61	55
A-C	-114.667	-18.9476	-647.669	-781.2836	188	48	6	22817	3	25	15
A-D	-51.1502	-40.5356	-293.256	-384.9417	106	22	5	11366	4	26	22
A-F	0.0	0.0	-2.864	-2.864	27	0	0	387	0	3	2
B-C	-81.669	-54.8328	-430.872	-567.3737	154	20	9	16290	4	12	12
B-D	-49.6321	-22.8858	-202.78	-275.2979	81	6	3	7407	1	16	16
B-F	-21.4019	-11.6455	162.168	129.1206	29	58	1	2728	0	3	3
C-D	-68.2671	-17.1838	-130.24	-215.6909	47	11	4	5234	2	6	8
C-F	-149.4417	-68.055	1084.91	867.4133	106	361	1	13910	3	18	18

Interface residues

• A-B: ALA108B, ALA12A, ALA139B, ALA15A, ALA177A, ALA191A, ALA214B, ALA216B, ALA235B, ALA24B, ALA30A, ALA33A, ALA47B, ALA60B, ALA67B, ALA72A, ALA84B, ALA97A, ARG104A, ARG105A, ARG114A, ARG13A, ARG177B, ARG180A, ARG223B, ARG226B, ARG237A, ARG246A, ARG251A, ARG254A, ARG275A, ARG286A, ARG59A, ARG70A, ARG97B, ARG98A, ARG99A, ASN105B, ASN11B, ASN167A, ASN176A, ASN189B, ASN190A, ASN211A, ASN218B, ASN263A, ASN267A, ASN270A, ASN42B, ASN55A, ASN56B, ASN57B, ASN61B, ASN66A, ASN96A, ASP116A, ASP140B, ASP157B, ASP16A, ASP17B, ASP182B, ASP18B, ASP219B, ASP227B, ASP273A, ASP283A, ASP29B, ASP35B, ASP46A, ASP50B, ASP66B, CYS121B, CYS164B, CYS167B, CYS192B, CYS212B, CYS217B, CYS73A, GLN102A, GLN12B, GLN161B, GLN20B, GLN233B, GLN238B, GLN27B, GLN41A, GLN49A, GLN63B, GLN86B, GLN88B, GLU102B, GLU108A, GLU118A, GLU183B, GLU274A, GLU35A, GLU39B, GLU43A, GLU45B, GLU48B, GLU61A, GLU65A, GLU71B, GLU77A, GLU80B, GLU92B, GLY101B, GLY112B, GLY138B, GLY159B, GLY175A, GLY188B, GLY189A, GLY232B, GLY37A, GLY38B, HIS109B, HIS153B, HIS175B, HIS244A, HIS33B, HIS38A, HIS41B, HIS57A, HIS69B, ILE103B, ILE114B, ILE119A, ILE155B, ILE158B, ILE168B, ILE170A, ILE171B, ILE183A, ILE186A, ILE188A, ILE231B, ILE245A, ILE259A, ILE278A, ILE285A, ILE28A, ILE36B, ILE46B, ILE58B, ILE70B, ILE76A, ILE82B, LEU103A, LEU109A, LEU116B, LEU132B, LEU160B, LEU166B, LEU211B, LEU225B, LEU236B, LEU237B, LEU255A, LEU271A, LEU31A, LEU43B, LEU62B, LEU68A, LEU91B, LEU99B, LYS106A, LYS115B, LYS241A, LYS243A, LYS260A, LYS54A, LYS59B, LYS81B, LYS96B, MET100A, MET100B, MET113A, MET117A, MET14B, MET154B, MET181A, MET216A, MET224B, MET25B, MET34B, MET44B, MET48A, MET65B, MET87B, PHE107A, PHE110A, PHE115A, PHE118B, PHE120B, PHE121A, PHE13B, PHE185A, PHE19B, PHE213B, PHE220B, PHE230B, PHE240A, PHE28B, PHE67A, PHE83B, PHE85B, PHE95B, PRO136B, PRO137B, PRO142B, PRO148A, PRO168A, PRO169B, PRO178A, PRO179A, PRO184A, PRO229B, PRO22B, PRO250A, PRO252A, PRO253A, PRO257A, PRO268A, PRO26B, PRO282A, PRO287A, PRO29A, PRO32B, PRO37B, PRO44A, PRO54B, SER10B, SER111B, SER113B, SER162B, SER163B, SER169A, SER16B, SER172B, SER182A, SER186B, SER187A, SER215B, SER21B, SER221B, SER23B, SER256A, SER261A, SER262A, SER276A, SER277A, SER40A, SER45A, SER51B, SER58A, SER60A, SER62A, SER64B, SER69A, SER71A, SER93B, THR111A, THR117B, THR119B, THR120A, THR152B, THR15B, THR166A, THR174B, THR17A, THR191B, THR228B, THR234B, THR269A, THR272A, THR279A, THR284A, THR31B, THR32A, THR36A, THR39A, THR47A, THR50A, THR63A, THR98B, TRP110B, TRP156B, TRP170B, TRP248A, TRP93A, TYR106B, TYR107B, TYR112A, TYR134B, TYR146A, TYR176B, TYR192A, TYR239A, TYR258A, TYR280A, TYR56A, TYR68B, TYR75A, VAL101A, VAL122A, VAL141B, VAL14A, VAL165B, VAL190B, VAL222B, VAL238A, VAL247A, VAL249A, VAL281A, VAL30B, VAL34A, VAL40B, VAL42A, VAL49B, VAL52B, VAL53A, VAL53B, VAL55B, VAL64A, VAL74A, VAL94B
• A-C: ALA129C, ALA141C, ALA142C, ALA172C, ALA191A, ALA197C, ALA212A, ALA28C, ALA33A, ALA46C, ALA84C, ARG104A, ARG105A, ARG114A, ARG11C, ARG192C, ARG214C, ARG251A, ARG254A, ARG255C, ARG36C, ARG98A, ASN144C, ASN171C, ASN180C, ASN190A, ASN190C, ASN194A, ASN194C, ASN195C, ASN205A, ASN205C, ASN211A, ASN211C, ASN217C, ASN263A, ASN265A, ASN267A, ASN270A, ASN29C, ASP10C, ASP137C, ASP197A, ASP210C, ASP44C, CYS120C, CYS125C, CYS133C, CYS170C, CYS196C, GLN135C, GLN166C, GLN187C, GLN204A, GLN259C, GLN260C, GLU108A, GLU128C, GLU130C, GLU139C, GLU26C, GLU35A, GLU45C, GLU83C, GLY132C, GLY148C, GLY173C, GLY175C, GLY177C, GLY179C, GLY189A, GLY198A, GLY206A, GLY209A, GLY37A, HIS163C, HIS186C, HIS201A, HIS215C, HIS38A, ILE168C, ILE183C, ILE188A, ILE189C, ILE199C, ILE259A, LEU100C, LEU109A, LEU121C, LEU122C, LEU145C, LEU181C, LEU191C, LEU213A, LEU255A, LEU271A, LEU41C, LYS138C, LYS147C, LYS158C, LYS260A, LYS80C, LYS86C, MET113A, MET131C, MET143C, MET174C, MET201C, MET209C, MET212C, MET221C, MET95C, PHE110A, PHE154C, PHE185A, PHE195A, PHE202A, PHE213C, PHE218C, PHE225C, PHE266A, PHE81C, PRO127C, PRO185C, PRO202C, PRO208C, PRO250A, PRO252A, PRO253A, PRO257A, PRO268A, SER134C, SER167C, SER187A, SER193A, SER200A, SER203A, SER206C, SER256A, SER262A, SER27C, THR111A, THR136C, THR146C, THR157C, THR159C, THR164C, THR182C, THR193C, THR198C, THR219C, THR269A, THR272A, THR32A, THR36A, THR39A, THR47C, TRP188C, TRP199A, TRP248A, TYR112A, TYR184C, TYR192A, TYR196A, TYR208A, TYR210A, TYR216C, TYR258A, TYR258C, TYR34C, TYR99C, VAL123C, VAL124C, VAL126C, VAL140C, VAL165C, VAL169C, VAL176C, VAL178C, VAL204C, VAL207A, VAL207C, VAL249A, VAL264A, VAL30C, VAL31C, VAL32C, VAL34A
• A-D: ALA12A, ALA15A, ALA30A, ALA33A, ALA36D, ALA37D, ALA41D, ALA67D, ARG13A, ARG180A, ARG246A, ARG43D, ARG59A, ARG70A, ASN39D, ASN42D, ASN66A, ASN69D, ASP116A, ASP35D, ASP45D, ASP46A, ASP49D, ASP59D, GLN41A, GLN44D, GLN48D, GLU118A, GLU35A, GLU43A, GLU55D, GLU61A, GLU65A, GLY37A, GLY51D, HIS244A, HIS38A, HIS57A, ILE11A, ILE183A, ILE186A, ILE245A, ILE28A, ILE60D, ILE62D, LEU31A, LEU68A, LEU68D, LYS241A, LYS243A, LYS52D, LYS58D, LYS63D, LYS9D, MET117A, MET181A, MET61D, MET65D, PHE110A, PHE115A, PHE185A, PHE46D, PHE53D, PHE67A, PRO184A, PRO242A, PRO250A, PRO29A, PRO44A, PRO50D, PRO56D, PRO66D, SER182A, SER25A, SER27A, SER38D, SER40A, SER40D, SER45A, SER58A, SER60A, SER62A, SER69A, SER71A, THR10D, THR15D, THR26A, THR32A, THR36A, THR39A, THR47A, THR47D, THR54D, THR63A, THR64D, THR7D, TRP248A, TYR33D, TYR56A, VAL14A, VAL247A, VAL249A, VAL34A, VAL42A, VAL57D, VAL64A
• A-F: ARG214F, ARG275A, ASN159F, ASN205A, ASN270A, GLN204A, GLU230F, GLU274A, GLY146F, GLY147F, GLY206A, HIS231F, LEU271A, PRO145F, PRO268A, SER203A, SER232F, SER276A, SER277A, THR160F, THR218F, THR269A, THR272A, TRP199A, TYR213F, TYR234F, VAL144F
• B-C: ALA113C, ALA124B, ALA126B, ALA172C, ALA214B, ALA226C, ALA231C, ALA232C, ALA234C, ALA28C, ALA46C, ALA47B, ALA67B, ALA75C, ARG102C, ARG11C, ARG192C, ARG36C, ARG42C, ARG97B, ASN171C, ASN180C, ASN190C, ASN194C, ASN205C, ASN206B, ASN61B, ASP229C, ASP35B, ASP44C, ASP50B, ASP66B, CYS120C, CYS121B, CYS170C, CYS208B, CYS212B, GLN118C, GLN161B, GLN233C, GLN63B, GLU102B, GLU155C, GLU26C, GLU39B, GLU39C, GLU45B, GLU45C, GLU71B, GLY101B, GLY119C, GLY122B, GLY128B, GLY159B, GLY175C, GLY177C, GLY179C, GLY203B, GLY33C, GLY35C, GLY38B, GLY76C, HIS117C, HIS186C, HIS33B, HIS69B, ILE103B, ILE158B, ILE168C, ILE183C, ILE189C, ILE223C, ILE36B, ILE46B, ILE70B, LEU121C, LEU122C, LEU160B, LEU181C, LEU191C, LEU211B, LEU228C, LEU41C, LEU43B, LEU62B, LEU99B, LYS115C, LYS158C, LYS207B, LYS72C, MET100B, MET125B, MET201C, MET209C, MET34B, MET65B, PHE116C, PHE120B, PHE213B, PHE225C, PRO127C, PRO156C, PRO185C, PRO201B, PRO202B, PRO202C, PRO205B, PRO208C, PRO224C, PRO227C, PRO32B, PRO37B, PRO38C, PRO54B, SER114C, SER123B, SER162B, SER163B, SER206C, SER51B, SER64B, SER74C, THR119B, THR127B, THR157C, THR182C, THR193C, THR204B, THR31B, THR47C, THR98B, TRP156B, TRP188C, TRP37C, TRP70C, TYR184C, TYR203C, TYR230C, TYR34C, TYR68B, VAL169C, VAL176C, VAL178C, VAL200B, VAL204C, VAL207C, VAL209B, VAL210B, VAL32C, VAL40B, VAL49B, VAL52B, VAL53B, VAL72B
• B-D: ALA216B, ALA24B, ALA36D, ALA37D, ALA41D, ALA47B, ALA67D, ARG223B, ARG43D, ASN218B, ASN29D, ASN31D, ASN39D, ASN42B, ASN42D, ASN69D, ASP17B, ASP18B, ASP35D, ASP45D, ASP49D, ASP50B, CYS217B, GLN161B, GLN20B, GLN27B, GLN48D, GLN4D, GLU39B, GLU45B, GLU48B, GLU55D, GLY38B, GLY51D, HIS41B, ILE30D, ILE36B, ILE46B, LEU160B, LEU225B, LEU43B, LEU68D, LEU99B, LYS115B, LYS34D, LYS52D, LYS63D, LYS9D, MET14B, MET25B, MET44B, MET61D, MET65D, PHE19B, PHE220B, PHE28B, PHE46D, PHE53D, PRO22B, PRO26B, PRO37B, PRO50D, PRO56D, PRO66D, SER162B, SER163B, SER16B, SER215B, SER21B, SER23B, SER38D, SER40D, THR15B, THR47D, THR54D, TYR32D, TYR33D, VAL165B, VAL30B, VAL40B, VAL49B
• B-F: ALA60B, ALA67B, ARG214F, ASN56B, ASN57B, ASN61B, ASP66B, CYS235F, GLN215F, GLN63B, GLU230F, GLY212F, GLY246F, ILE233F, ILE58B, LEU62B, LYS59B, MET65B, SER216F, SER232F, SER245F, SER64B, THR160F, THR218F, THR236F, TRP244F, TYR213F, TYR234F, VAL217F
• C-D: ALA28C, ALA67D, ARG11C, ARG13C, ARG36C, ASN190C, ASN194C, ASN29C, ASN69D, ASP10C, ASP49D, ASP59D, GLN187C, GLU26C, GLU55D, GLY33C, GLY35C, GLY51D, HIS186C, ILE183C, ILE199C, ILE60D, LEU15C, LEU68D, LYS52D, LYS58D, MET61D, PHE53D, PRO185C, PRO56D, PRO66D, SER14C, SER27C, SER9C, THR182C, THR193C, THR198C, THR54D, TRP37C, TYR184C, TYR34C, VAL12C, VAL200C, VAL30C, VAL31C, VAL32C, VAL57D
• C-F: ALA141C, ALA142C, ALA150C, ALA151C, ALA152F, ALA257C, ALA75C, ARG138F, ARG214F, ASN133F, ASN139F, ASN144C, ASN159F, ASN160C, ASN171C, ASN238F, ASN73C, ASP143F, ASP240F, CYS133C, CYS158F, CYS170C, CYS188F, GLN135C, GLN141F, GLN166C, GLN259C, GLN260C, GLN69C, GLU104F, GLU124F, GLU136F, GLU139C, GLU155C, GLU162C, GLU190F, GLU66C, GLU71C, GLY132C, GLY135F, GLY140F, GLY146F, GLY147F, GLY161C, GLY161F, GLY173C, GLY76C, HIS152C, HIS163C, ILE137F, ILE142F, ILE148F, ILE154F, ILE168C, ILE191F, LEU107F, LEU145C, LEU149F, LEU164F, LEU256C, LYS127F, LYS128F, LYS138C, LYS147C, LYS153C, LYS158C, LYS163F, LYS72C, LYS86C, MET131C, MET143C, PHE154C, PHE156F, PRO134F, PRO145F, PRO156C, SER106F, SER134C, SER155F, SER157F, SER167C, SER169F, SER170F, SER74C, THR146C, THR153F, THR157C, THR159C, THR160F, THR164C, THR168F, TRP181F, TRP70C, TRP77C, TRP78C, TYR162F, TYR213F, TYR258C, TYR97C, VAL123F, VAL140C, VAL144F, VAL165C, VAL169C, VAL237F, VAL68C