3N6V

structure of the glua2 ntd-dimer interface mutant, t78a

• Total interactions analyzed: 15
• Total true interactions: 6
• Strongest Interaction:
  • Chains: A-E
  • Int. Res.: 47
  • Norm. En. per Res.: -2.2445
• 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	-9.449	32.6963	-282.888	-259.6408	155	9	9	13104	0	24	36
A-D	0.0	18.3115	-70.0784	-51.767	41	1	1	3327	0	6	6
A-E	-17.1206	0.0	-88.3693	-105.4899	47	10	4	3618	0	8	24
B-D	0.0	-29.0193	-47.1922	-76.2116	44	3	0	2316	3	25	21
C-D	-7.7304	15.5834	-271.521	-263.6679	151	13	8	12369	0	23	34
E-F	-38.136	20.5912	-251.191	-268.7358	159	45	10	13254	0	27	36

Interface residues

• A-B: ALA128B, ALA142A, ALA142B, ALA147A, ALA147B, ALA148A, ALA148B, ALA156A, ALA156B, ALA311A, ALA311B, ALA314A, ALA314B, ALA47A, ALA47B, ALA51A, ALA51B, ALA55A, ALA55B, ALA78A, ALA78B, ARG62B, ASN158A, ASN158B, ASN161A, ASN161B, ASN312A, ASN312B, ASN48A, ASN48B, ASN54A, ASN54B, ASN77A, ASN77B, ASP132A, ASP132B, ASP134A, ASP145A, ASP145B, ASP177A, ASP177B, ASP308A, ASP308B, ASP42B, ASP72A, ASP72B, ASP98A, ASP98B, CYS309A, CYS309B, CYS57A, CYS57B, CYS83A, CYS83B, GLN141A, GLN141B, GLN153A, GLN153B, GLN176B, GLU149A, GLU149B, GLY136A, GLY136B, GLY160A, GLY160B, GLY84A, GLY84B, GLY99A, GLY99B, HIS101A, HIS101B, ILE157A, ILE157B, ILE79A, ILE79B, LEU137A, LEU137B, LEU140A, LEU140B, LEU144A, LEU144B, LEU174A, LEU174B, LEU178A, LEU178B, LEU180A, LEU180B, LEU310A, LEU310B, LEU86A, LEU86B, LYS150A, LYS150B, LYS151A, LYS151B, LYS181A, LYS181B, LYS73A, LYS73B, LYS74A, LYS74B, PHE50A, PHE50B, PHE56A, PHE56B, PHE60A, PHE60B, PHE82A, PHE82B, PRO102A, PRO313A, PRO313B, SER133A, SER133B, SER138A, SER138B, SER146A, SER146B, SER49A, SER49B, SER58A, SER58B, SER61B, SER75A, SER75B, SER81A, SER81B, THR100A, THR155A, THR155B, THR53A, THR53B, THR80A, THR80B, THR85A, THR85B, THR97A, THR97B, TRP152A, TRP152B, TYR129A, TYR129B, TYR131A, TYR131B, VAL143A, VAL154A, VAL154B, VAL159A, VAL159B, VAL315A, VAL315B, VAL52A, VAL52B, VAL76A, VAL76B
• A-D: ALA306A, ALA311A, ALA314A, ARG24D, ARG255D, ASN305A, ASN312A, ASP308A, CYS309A, GLN29D, GLN319A, GLU254D, GLU260D, GLU261D, GLU263D, GLY26D, GLY307A, GLY318A, HIS268D, ILE253D, LEU259D, LEU310A, LEU86A, LYS251D, MET27D, PHE252D, PHE30D, PHE60A, PRO313A, PRO316A, SER257D, SER301A, SER31D, THR258D, TRP256D, TRP317A, TYR264D, TYR280D, VAL25D, VAL28D, VAL315A
• A-E: ALA234A, ALA234E, ARG172A, ARG172E, ASP168A, ASP168E, ASP200A, ASP200E, GLN201A, GLN201E, GLN230A, GLN230E, GLU169E, GLY206A, GLY206E, GLY232A, GLY232E, GLY233A, GLY233E, HIS208A, HIS208E, ILE203A, ILE203E, ILE205A, ILE205E, ILE229A, ILE229E, LEU227A, LEU227E, LYS207A, LYS207E, LYS210A, LYS210E, LYS228A, LYS228E, PHE231A, PHE231E, SER173E, THR204A, THR204E, THR359A, TYR212A, TYR212E, VAL202A, VAL202E, VAL209A, VAL209E
• B-D: ALA267B, ARG14B, ARG24B, ARG255D, ARG291D, ARG294D, ARG297D, ARG62B, ASN292D, ASN305B, ASN43B, ASN54B, ASP17B, GLN296D, GLN29D, GLU260B, GLU261B, GLU263B, GLU333D, GLU34D, GLU45B, GLY15B, GLY266B, HIS268B, HIS40B, ILE298D, LEU248D, LEU44B, LYS251D, LYS262B, LYS295D, PHE30D, PHE35D, PHE50B, PRO265B, SER247D, SER31D, SER33D, SER58B, SER61B, THR32D, TYR20B, TYR264B, VAL28D
• C-D: ALA142C, ALA142D, ALA147C, ALA147D, ALA148C, ALA148D, ALA156C, ALA156D, ALA311C, ALA311D, ALA314C, ALA314D, ALA47C, ALA47D, ALA51C, ALA51D, ALA55C, ALA55D, ALA78C, ALA78D, ASN158C, ASN158D, ASN161C, ASN161D, ASN312C, ASN312D, ASN48C, ASN48D, ASN54C, ASN54D, ASN77C, ASN77D, ASP132C, ASP132D, ASP134D, ASP145C, ASP145D, ASP177C, ASP177D, ASP308C, ASP308D, ASP72C, ASP72D, ASP98C, ASP98D, CYS309C, CYS309D, CYS57C, CYS57D, CYS83C, CYS83D, GLN141C, GLN141D, GLN153C, GLN153D, GLU149C, GLU149D, GLY136C, GLY136D, GLY160D, GLY84C, GLY84D, GLY99C, GLY99D, HIS101C, HIS101D, ILE157C, ILE157D, ILE79C, ILE79D, LEU137C, LEU137D, LEU140C, LEU140D, LEU144C, LEU144D, LEU174C, LEU174D, LEU178C, LEU178D, LEU180C, LEU180D, LEU310C, LEU310D, LEU86C, LEU86D, LYS150C, LYS150D, LYS151C, LYS151D, LYS181C, LYS181D, LYS73C, LYS73D, LYS74C, LYS74D, PHE50C, PHE50D, PHE56C, PHE56D, PHE60C, PHE60D, PHE82C, PHE82D, PRO102C, PRO102D, PRO313C, PRO313D, SER133C, SER133D, SER138C, SER138D, SER146C, SER146D, SER49C, SER49D, SER58C, SER58D, SER61C, SER61D, SER75C, SER75D, SER81C, SER81D, THR100C, THR100D, THR155C, THR155D, THR53C, THR53D, THR80C, THR80D, THR85C, THR85D, THR97C, THR97D, TRP152C, TRP152D, TYR129C, TYR129D, TYR131C, TYR131D, VAL154C, VAL154D, VAL159D, VAL315C, VAL315D, VAL52C, VAL52D, VAL76C, VAL76D
• E-F: ALA128E, ALA142E, ALA142F, ALA147E, ALA147F, ALA148E, ALA148F, ALA156E, ALA156F, ALA311E, ALA311F, ALA314E, ALA314F, ALA47E, ALA47F, ALA51E, ALA51F, ALA55E, ALA55F, ALA78E, ALA78F, ASN158E, ASN158F, ASN161E, ASN161F, ASN312E, ASN312F, ASN48E, ASN48F, ASN54E, ASN54F, ASN77E, ASN77F, ASP132E, ASP132F, ASP145E, ASP145F, ASP177E, ASP177F, ASP308E, ASP308F, ASP42E, ASP72E, ASP72F, ASP98E, ASP98F, CYS309E, CYS309F, CYS57E, CYS57F, CYS83E, CYS83F, GLN141E, GLN141F, GLN153E, GLN153F, GLN176E, GLU149E, GLU149F, GLU183E, GLU45E, GLY136E, GLY160E, GLY84E, GLY84F, GLY99E, GLY99F, HIS101E, HIS101F, HIS40E, HIS87E, HIS87F, ILE157E, ILE157F, ILE79E, ILE79F, LEU130E, LEU137E, LEU137F, LEU140E, LEU140F, LEU144E, LEU144F, LEU174E, LEU174F, LEU178E, LEU178F, LEU180E, LEU180F, LEU310E, LEU310F, LEU86E, LEU86F, LYS112F, LYS150F, LYS151E, LYS151F, LYS181E, LYS181F, LYS73E, LYS73F, LYS74E, LYS74F, PHE50E, PHE50F, PHE56E, PHE56F, PHE60E, PHE60F, PHE82E, PHE82F, PRO313E, PRO313F, PRO316E, PRO316F, SER133E, SER133F, SER138E, SER138F, SER146E, SER146F, SER49E, SER49F, SER58E, SER58F, SER61E, SER61F, SER75E, SER75F, SER81E, SER81F, THR100E, THR155E, THR155F, THR53E, THR53F, THR80E, THR80F, THR85E, THR85F, THR97E, TRP152E, TRP152F, TYR129E, TYR129F, TYR131E, TYR131F, VAL143E, VAL143F, VAL154E, VAL154F, VAL159E, VAL315E, VAL315F, VAL46E, VAL52E, VAL52F, VAL76E, VAL76F