3FTN

q165e/s254k double mutant chimera of alcohol dehydrogenase by exchange of the cofactor binding domain res 153-295 of t. brockii adh by c. beijerinckii adh

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: B-D
  • Int. Res.: 162
  • Norm. En. per Res.: -4.9077
• 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	-35.499	-79.3065	-337.429	-452.2345	118	15	0	12750	11	53	57
A-C	-174.7463	-2.6874	-632.975	-810.4087	169	35	9	22431	0	34	51
A-D	-42.5133	-95.1206	-176.927	-314.5609	70	10	0	6789	4	29	36
B-C	-34.0422	-91.8463	-163.631	-289.5195	67	13	0	6521	4	31	36
B-D	-180.8515	-2.4743	-611.722	-795.0478	162	36	8	21806	0	34	50
C-D	-33.4078	-69.703	-337.921	-441.0318	116	13	0	12702	8	53	56

Interface residues

• A-B: ALA159A, ALA159B, ALA184A, ALA184B, ALA186A, ALA186B, ALA191A, ALA191B, ALA212A, ALA212B, ARG189A, ARG189B, ARG193A, ARG193B, ARG238A, ARG238B, ARG299A, ARG299B, ARG301A, ARG301B, ARG304A, ARG304B, ARG313A, ARG313B, ASP163A, ASP163B, ASP214A, ASP214B, ASP237A, ASP237B, ASP307A, ASP307B, GLU160A, GLU160B, GLU165A, GLU165B, GLU303A, GLU303B, GLY155A, GLY155B, GLY167A, GLY167B, GLY182A, GLY182B, GLY185A, GLY185B, GLY190A, GLY190B, GLY192A, GLY192B, GLY211A, GLY211B, GLY260B, HIS157A, HIS157B, ILE164A, ILE164B, ILE183A, ILE183B, ILE194A, ILE194B, ILE195A, ILE195B, ILE306A, ILE306B, LEU188A, LEU188B, LEU230A, LEU230B, LEU300A, LEU300B, LEU305A, LEU305B, LEU308A, LEU308B, LYS187A, LYS187B, LYS208A, LYS208B, LYS234A, LYS234B, LYS257A, LYS257B, LYS312A, LYS312B, MET152A, MET152B, MET166A, MET166B, MET181A, MET181B, PHE156A, PHE156B, PHE209A, PHE209B, PHE310A, PHE310B, PRO296A, SER168A, SER168B, SER169A, SER169B, THR153A, THR153B, THR213A, THR213B, THR231A, TYR210A, TYR210B, TYR311A, TYR311B, VAL170A, VAL170B, VAL236B, VAL309A, VAL309B, VAL314A, VAL314B
• A-C: ALA108A, ALA108C, ALA273A, ALA273C, ALA286A, ALA286C, ALA48A, ALA48C, ARG238A, ARG238C, ARG278A, ARG278C, ARG97A, ARG97C, ASN114A, ASN114C, ASN264A, ASN264C, ASN266A, ASN266C, ASP163C, ASP237A, ASP237C, ASP272A, ASP272C, CYS283A, CYS283C, CYS295A, CYS295C, GLN101A, GLN101C, GLN96A, GLN96C, GLU160A, GLU160C, GLU165A, GLU165C, GLU280A, GLU280C, GLU46A, GLU46C, GLU94A, GLU94C, GLY104A, GLY104C, GLY105A, GLY105C, GLY259A, GLY259C, GLY260A, GLY260C, GLY269A, GLY269C, GLY271A, GLY271C, GLY282A, GLY282C, GLY284A, GLY284C, GLY292A, GLY292C, GLY293A, GLY293C, GLY47A, GLY47C, GLY50A, GLY50C, GLY98A, GLY98C, HIS100A, HIS100C, HIS102A, HIS102C, HIS157A, HIS157C, HIS268A, HIS268C, HIS287A, HIS287C, HIS42A, HIS42C, ILE261A, ILE261C, ILE262A, ILE262C, ILE265A, ILE265C, ILE276A, ILE276C, ILE290A, ILE290C, ILE49A, ILE49C, ILE86A, ILE86C, LEU107A, LEU107C, LEU161A, LEU161C, LEU249A, LEU249C, LEU274A, LEU274C, LEU275A, LEU275C, LEU294A, LEU294C, LYS234A, LYS234C, LYS254A, LYS254C, LYS257A, LYS257C, LYS288A, LYS288C, LYS291A, LYS291C, MET106A, MET106C, MET241A, MET241C, MET285A, MET285C, PRO258A, PRO258C, PRO277A, PRO277C, PRO296A, PRO296C, SER103A, SER103C, SER168A, SER168C, SER169A, SER169C, SER246A, SER246C, SER250A, SER250C, SER263A, SER263C, SER270A, SER270C, SER39A, SER39C, SER93A, SER93C, THR154A, THR154C, THR289A, THR289C, THR43A, THR43C, TRP110A, TRP110C, TRP281A, TRP281C, TYR267A, TYR267C, TYR99A, TYR99C, VAL236A, VAL236C, VAL253A, VAL253C, VAL256A, VAL256C, VAL279A, VAL279C
• A-D: ALA129A, ALA129D, ARG299A, ARG299D, ARG301A, ARG301D, ARG304A, ARG304D, ARG91A, ARG91D, ARG97A, ARG97D, ASN127A, ASN127D, ASN132A, ASN132D, ASP128A, ASP128D, ASP130A, ASP130D, ASP26A, ASP26D, ASP74A, ASP89A, ASP89D, GLN96A, GLN96D, GLU303A, GLU303D, GLU71A, GLU71D, GLU94A, GLU94D, GLY297A, GLY297D, GLY298A, GLY298D, GLY98A, GLY98D, HIS100A, HIS100D, LEU133A, LEU133D, LEU300A, LEU300D, LYS73A, LYS73D, MET131A, MET131D, MET302A, MET302D, PHE25A, PHE25D, PRO24A, PRO24D, PRO88A, PRO88D, SER103D, SER93A, SER93D, THR92A, THR92D, TRP90A, TRP90D, TYR99A, TYR99D, VAL72A, VAL72D, VAL95A, VAL95D
• B-C: ALA129B, ALA129C, ARG299B, ARG299C, ARG301B, ARG301C, ARG304B, ARG304C, ARG91B, ARG91C, ARG97B, ARG97C, ASN127B, ASN127C, ASN132B, ASN132C, ASP128B, ASP128C, ASP130B, ASP130C, ASP26B, ASP26C, ASP89B, ASP89C, GLN96B, GLN96C, GLU303B, GLU303C, GLU71B, GLU71C, GLU94B, GLU94C, GLY297B, GLY297C, GLY298B, GLY298C, GLY98B, GLY98C, HIS100B, HIS100C, LEU133B, LEU133C, LEU300B, LEU300C, LYS73B, LYS73C, MET131B, MET131C, MET302B, MET302C, PHE25B, PHE25C, PRO24B, PRO24C, PRO88B, PRO88C, SER93B, SER93C, THR92B, THR92C, TRP90B, TRP90C, TYR99C, VAL72B, VAL72C, VAL95B, VAL95C
• B-D: ALA108B, ALA108D, ALA273B, ALA273D, ALA286B, ALA286D, ALA48B, ALA48D, ARG238B, ARG238D, ARG278B, ARG278D, ARG97B, ARG97D, ASN114B, ASN264B, ASN264D, ASN266B, ASN266D, ASP237B, ASP237D, ASP272B, ASP272D, CYS283B, CYS283D, CYS295B, CYS295D, GLN101B, GLN101D, GLN96B, GLN96D, GLU160B, GLU160D, GLU165B, GLU165D, GLU280B, GLU280D, GLU46B, GLU46D, GLU94B, GLU94D, GLY104B, GLY104D, GLY105B, GLY105D, GLY259B, GLY259D, GLY260B, GLY260D, GLY269B, GLY269D, GLY271B, GLY271D, GLY282B, GLY282D, GLY284B, GLY284D, GLY292B, GLY292D, GLY293B, GLY293D, GLY47B, GLY47D, GLY98B, GLY98D, HIS100B, HIS100D, HIS102B, HIS102D, HIS157B, HIS157D, HIS268B, HIS268D, HIS287B, HIS287D, HIS42B, HIS42D, ILE261B, ILE261D, ILE262B, ILE262D, ILE265B, ILE265D, ILE276B, ILE276D, ILE290B, ILE290D, ILE49B, ILE49D, ILE86B, ILE86D, LEU107B, LEU107D, LEU161B, LEU161D, LEU249B, LEU249D, LEU274B, LEU274D, LEU275B, LEU275D, LEU294B, LEU294D, LYS234B, LYS234D, LYS254B, LYS254D, LYS257B, LYS257D, LYS288B, LYS288D, LYS291B, LYS291D, MET106B, MET106D, MET241B, MET241D, MET285B, MET285D, PRO258B, PRO258D, PRO277B, PRO277D, PRO296B, PRO296D, SER103B, SER103D, SER168B, SER168D, SER169D, SER246B, SER246D, SER250B, SER250D, SER263B, SER263D, SER270B, SER270D, SER39B, SER39D, SER93B, SER93D, THR154B, THR154D, THR289B, THR289D, TRP110B, TRP110D, TRP281B, TRP281D, TYR267B, TYR267D, TYR99B, TYR99D, VAL236B, VAL236D, VAL253B, VAL253D, VAL256B, VAL256D, VAL279B, VAL279D
• C-D: ALA159C, ALA159D, ALA184C, ALA184D, ALA186C, ALA186D, ALA191C, ALA191D, ALA212C, ALA212D, ARG189C, ARG189D, ARG193C, ARG193D, ARG238C, ARG238D, ARG299C, ARG299D, ARG301C, ARG301D, ARG304C, ARG304D, ARG313C, ARG313D, ASP163C, ASP163D, ASP214C, ASP214D, ASP237C, ASP237D, ASP307C, ASP307D, GLU160C, GLU160D, GLU165C, GLU165D, GLU303C, GLU303D, GLY155C, GLY155D, GLY167C, GLY167D, GLY182C, GLY182D, GLY185C, GLY185D, GLY190C, GLY190D, GLY192C, GLY192D, GLY211C, GLY211D, GLY260C, HIS135D, HIS157C, HIS157D, ILE164C, ILE164D, ILE183C, ILE183D, ILE194C, ILE194D, ILE195C, ILE195D, ILE306C, ILE306D, LEU188C, LEU188D, LEU230C, LEU300C, LEU300D, LEU305C, LEU305D, LEU308C, LEU308D, LYS187C, LYS187D, LYS208C, LYS208D, LYS234C, LYS234D, LYS257C, LYS257D, LYS312C, LYS312D, MET152C, MET152D, MET166C, MET166D, MET181C, MET181D, MET302D, PHE156C, PHE156D, PHE209C, PHE209D, PHE310C, PHE310D, PRO296D, SER168C, SER168D, SER169C, SER169D, THR213C, THR213D, THR231C, TYR210C, TYR210D, TYR311C, TYR311D, VAL170C, VAL170D, VAL309C, VAL309D, VAL314C, VAL314D