3FH6

crystal structure of the resting state maltose transporter from e. coli

• Total interactions analyzed: 28
• Total true interactions: 12
• Strongest Interaction:
  • Chains: G-A
  • Int. Res.: 63
  • Norm. En. per Res.: -2.2322
• Hub Node: F(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
F-G	-25.4646	-0.3004	-436.174	-461.9391	303	129	36	31052	0	8	11
F-B	-3.3283	-30.1658	-112.683	-146.1772	73	11	6	5956	3	16	20
F-D	0.0	0.0	-3.6309	-3.6309	8	0	0	169	0	0	0
G-A	-17.6276	-28.4061	-94.5947	-140.6283	63	13	5	5176	1	15	10
G-B	0.0	-5.7054	-45.2078	-50.9132	24	3	0	2962	0	2	1
A-B	-15.1013	-61.2357	-129.85	-206.1869	123	19	4	9128	7	52	37
A-D	0.0	0.0	-0.3325	-0.3325	11	0	0	92	0	7	7
H-I	-25.4518	-0.3015	-436.613	-462.3663	303	128	36	31079	0	8	11
H-D	-3.3258	-30.1645	-114.603	-148.0933	73	10	6	5952	3	16	20
I-C	-13.1937	-28.4079	-97.7024	-139.304	63	13	5	5166	1	15	10
I-D	0.0	-5.7062	-45.1428	-50.849	24	3	0	2958	0	2	1
C-D	-15.0916	-61.2408	-141.527	-217.8595	123	19	4	9132	7	52	37

Interface residues

• F-G: ALA111G, ALA119G, ALA133G, ALA139G, ALA142G, ALA165G, ALA171G, ALA225G, ALA246G, ALA25G, ALA264G, ALA265G, ALA266G, ALA267G, ALA26G, ALA271G, ALA297F, ALA310F, ALA315F, ALA326F, ALA36G, ALA402F, ALA404F, ALA408F, ALA432F, ALA435F, ALA43F, ALA475F, ALA487F, ALA489F, ALA491F, ALA500F, ALA502F, ALA508F, ALA88F, ALA90F, ARG104F, ARG12G, ARG146G, ARG312F, ARG318F, ARG473F, ARG510F, ASN254G, ASN257G, ASN287G, ASN341F, ASN348F, ASN413F, ASN437F, ASN439F, ASN440F, ASN449F, ASN469F, ASN505F, ASP145G, CYS106G, CYS304F, CYS85F, GLN129G, GLN250G, GLN251G, GLN256G, GLN282G, GLN342F, GLN412F, GLN445F, GLN5G, GLN99F, GLN9G, GLU149G, GLU182G, GLU229G, GLU309F, GLU346F, GLU401F, GLY124G, GLY160G, GLY161G, GLY168G, GLY169G, GLY179G, GLY248G, GLY261G, GLY313F, GLY338F, GLY345F, GLY390F, GLY407F, GLY409F, GLY485F, GLY499F, GLY71F, GLY74F, GLY76F, HIS17G, ILE127G, ILE151G, ILE154G, ILE15G, ILE163G, ILE170G, ILE224G, ILE227G, ILE24G, ILE274G, ILE276G, ILE27G, ILE322F, ILE331F, ILE333F, ILE335F, ILE347F, ILE374F, ILE37G, ILE386F, ILE431F, ILE474F, ILE490F, ILE494F, ILE503F, ILE87F, ILE89F, LEU100F, LEU102G, LEU121G, LEU122G, LEU126G, LEU135G, LEU137G, LEU13G, LEU140G, LEU143G, LEU147G, LEU167G, LEU18G, LEU19G, LEU20G, LEU21G, LEU221G, LEU22G, LEU235G, LEU236G, LEU245G, LEU253G, LEU259G, LEU272G, LEU279G, LEU285G, LEU302F, LEU305F, LEU311F, LEU31G, LEU320F, LEU321F, LEU323F, LEU32G, LEU334F, LEU339F, LEU351F, LEU379F, LEU41F, LEU429F, LEU443F, LEU446F, LEU447F, LEU467F, LEU486F, LEU493F, LEU496F, LEU497F, LEU501F, LEU506F, LEU77F, LEU80F, LEU83F, LEU85G, LYS118G, LYS123G, LYS178G, LYS314F, LYS337F, LYS393F, LYS7G, MET125G, MET130G, MET249G, MET269G, MET28G, MET33G, MET349F, MET350F, MET389F, MET3G, MET405F, MET511F, MET72F, MET75F, PHE110G, PHE115G, PHE128G, PHE131G, PHE144G, PHE14G, PHE164G, PHE23G, PHE263G, PHE278G, PHE29G, PHE330F, PHE336F, PHE340F, PHE344F, PHE362F, PHE411F, PHE42F, PHE434F, PHE436F, PHE438F, PHE441F, PHE476F, PHE484F, PHE495F, PHE513F, PHE78F, PHE81F, PHE91F, PRO132G, PRO231G, PRO255G, PRO273G, PRO30G, PRO324F, PRO328F, PRO382F, PRO410F, PRO428F, PRO82F, SER136G, SER234G, SER270G, SER329F, SER332F, SER343F, SER403F, SER433F, SER88G, SER8G, THR120G, THR16G, THR183G, THR228G, THR244G, THR275G, THR377F, THR448F, THR45F, THR46F, THR471F, THR492F, THR509F, THR86F, TRP175G, TRP260G, TRP308F, TRP378F, TRP84G, TYR141G, TYR150G, TYR166G, TYR252G, TYR258G, TYR317F, TYR325F, TYR381F, TYR400F, TYR470F, TYR472F, TYR94F, VAL134G, VAL138G, VAL174G, VAL230G, VAL232G, VAL247G, VAL268G, VAL277G, VAL298F, VAL301F, VAL306F, VAL316F, VAL319F, VAL327F, VAL34G, VAL35G, VAL442F, VAL468F, VAL498F, VAL4G, VAL504F, VAL79F, VAL81G, VAL84F
• F-B: ALA103B, ALA150B, ALA402F, ALA404F, ALA408F, ALA50B, ALA73B, ALA85B, ARG139B, ARG146B, ARG47B, ARG75B, ASN95B, ASP158B, ASP397F, ASP398F, ASP406F, ASP514F, GLN412F, GLN82B, GLU401F, GLU53B, GLU74B, GLY104B, GLY407F, GLY409F, GLY51B, GLY76B, GLY78B, GLY99B, HIS89B, ILE395F, ILE417F, ILE423F, ILE49B, LEU100B, LEU102B, LEU156B, LEU399F, LEU421F, LEU422F, LEU46B, LEU52B, LEU86B, LEU90B, LYS101B, LYS132B, LYS416F, LYS424F, LYS512F, MET405F, MET79B, MET96B, PHE155B, PHE513F, PHE81B, PHE98B, PRO152B, PRO396F, PRO420F, PRO71B, PRO72B, PRO88B, SER403F, SER83B, THR147B, THR418F, TYR400F, TYR84B, TYR87B, VAL154B, VAL77B, VAL80B
• F-D: GLU64D, GLU74D, ILE56F, LEU54F, LYS65D, TYR55F, TYR67F, VAL68F
• G-A: ALA103A, ALA150A, ALA191G, ALA192G, ALA193G, ALA197G, ALA202G, ALA50A, ALA73A, ALA85A, ARG114G, ARG146A, ARG47A, ARG75A, ASN287G, ASN95A, ASP185G, ASP195G, GLN201G, GLN82A, GLU189G, GLU190G, GLU53A, GLU74A, GLY196G, GLY51A, GLY76A, GLY78A, GLY99A, HIS89A, ILE184G, LEU100A, LEU102A, LEU188G, LEU194G, LEU205G, LEU207G, LEU210G, LEU52A, LEU86A, LEU90A, LYS101A, LYS132A, MET79A, PHE81A, PHE98A, PRO131A, PRO209G, PRO71A, PRO72A, PRO88A, SER186G, SER187G, SER83A, THR147A, TRP13A, TYR180G, TYR84A, TYR87A, VAL206G, VAL286G, VAL77A, VAL80A
• G-B: ALA50B, ALA73B, ARG47B, ARG75B, ASN68B, ASP69B, GLN5G, GLU53B, GLU74B, GLY51B, ILE55B, LEU52B, LYS11B, LYS7G, MET3G, MET48B, MET67B, PRO6G, PRO71B, PRO72B, THR54B, THR70B, TRP13B, VAL4G
• A-B: ALA166A, ALA166B, ALA167A, ALA167B, ALA197B, ALA201B, ALA372A, ALA372B, ARG173A, ARG173B, ARG178A, ARG178B, ARG286A, ARG286B, ARG330A, ARG330B, ARG351A, ARG351B, ASN312A, ASN312B, ASN326A, ASN326B, ASN332A, ASN332B, ASP165A, ASP193A, ASP333A, ASP333B, GLN171A, GLN171B, GLN194A, GLN194B, GLN305A, GLN305B, GLN309A, GLN309B, GLN315A, GLN315B, GLN319A, GLN319B, GLN325B, GLN331A, GLN331B, GLU196A, GLU196B, GLU288A, GLU288B, GLU308A, GLU308B, GLU313A, GLU313B, GLU339A, GLU339B, GLU368A, GLU368B, GLY235A, GLY235B, GLY311A, GLY311B, GLY370A, GLY370B, HIS192A, HIS223A, HIS223B, HIS289A, HIS289B, HIS317A, HIS317B, ILE174A, ILE174B, ILE234A, ILE234B, LEU200A, LEU200B, LEU219A, LEU219B, LEU291A, LEU310A, LEU310B, LEU336A, LEU336B, LYS181A, LYS181B, LYS217B, LYS238A, LYS238B, MET198A, MET198B, PHE233A, PRO218A, PRO218B, PRO237A, PRO237B, PRO287A, PRO287B, PRO369A, PRO369B, SER177A, SER177B, SER236A, SER236B, SER38B, THR199A, THR199B, THR314A, THR314B, TYR222A, TYR222B, VAL170A, VAL170B, VAL195A, VAL195B, VAL306A, VAL306B, VAL307A, VAL307B, VAL328A, VAL334A, VAL334B, VAL335A, VAL335B, VAL371A, VAL371B
• A-D: ALA372D, ARG273D, ARG363D, ARG66A, ASP59A, GLN7A, GLU64A, LYS367D, LYS65A, PHE61A, SER373D
• H-I: ALA111I, ALA119I, ALA133I, ALA139I, ALA142I, ALA165I, ALA171I, ALA225I, ALA246I, ALA25I, ALA264I, ALA265I, ALA266I, ALA267I, ALA26I, ALA271I, ALA297H, ALA310H, ALA315H, ALA326H, ALA36I, ALA402H, ALA404H, ALA408H, ALA432H, ALA435H, ALA43H, ALA475H, ALA487H, ALA489H, ALA491H, ALA500H, ALA502H, ALA508H, ALA88H, ALA90H, ARG104H, ARG12I, ARG146I, ARG312H, ARG318H, ARG473H, ARG510H, ASN254I, ASN257I, ASN287I, ASN341H, ASN348H, ASN413H, ASN437H, ASN439H, ASN440H, ASN449H, ASN469H, ASN505H, ASP145I, CYS106I, CYS304H, CYS85H, GLN129I, GLN250I, GLN251I, GLN256I, GLN282I, GLN342H, GLN412H, GLN445H, GLN5I, GLN99H, GLN9I, GLU149I, GLU182I, GLU229I, GLU309H, GLU346H, GLU401H, GLY124I, GLY160I, GLY161I, GLY168I, GLY169I, GLY179I, GLY248I, GLY261I, GLY313H, GLY338H, GLY345H, GLY390H, GLY407H, GLY409H, GLY485H, GLY499H, GLY71H, GLY74H, GLY76H, HIS17I, ILE127I, ILE151I, ILE154I, ILE15I, ILE163I, ILE170I, ILE224I, ILE227I, ILE24I, ILE274I, ILE276I, ILE27I, ILE322H, ILE331H, ILE333H, ILE335H, ILE347H, ILE374H, ILE37I, ILE386H, ILE431H, ILE474H, ILE490H, ILE494H, ILE503H, ILE87H, ILE89H, LEU100H, LEU102I, LEU121I, LEU122I, LEU126I, LEU135I, LEU137I, LEU13I, LEU140I, LEU143I, LEU147I, LEU167I, LEU18I, LEU19I, LEU20I, LEU21I, LEU221I, LEU22I, LEU235I, LEU236I, LEU245I, LEU253I, LEU259I, LEU272I, LEU279I, LEU285I, LEU302H, LEU305H, LEU311H, LEU31I, LEU320H, LEU321H, LEU323H, LEU32I, LEU334H, LEU339H, LEU351H, LEU379H, LEU41H, LEU429H, LEU443H, LEU446H, LEU447H, LEU467H, LEU486H, LEU493H, LEU496H, LEU497H, LEU501H, LEU506H, LEU77H, LEU80H, LEU83H, LEU85I, LYS118I, LYS123I, LYS178I, LYS314H, LYS337H, LYS393H, LYS7I, MET125I, MET130I, MET249I, MET269I, MET28I, MET33I, MET349H, MET350H, MET389H, MET3I, MET405H, MET511H, MET72H, MET75H, PHE110I, PHE115I, PHE128I, PHE131I, PHE144I, PHE14I, PHE164I, PHE23I, PHE263I, PHE278I, PHE29I, PHE330H, PHE336H, PHE340H, PHE344H, PHE362H, PHE411H, PHE42H, PHE434H, PHE436H, PHE438H, PHE441H, PHE476H, PHE484H, PHE495H, PHE513H, PHE78H, PHE81H, PHE91H, PRO132I, PRO231I, PRO255I, PRO273I, PRO30I, PRO324H, PRO328H, PRO382H, PRO410H, PRO428H, PRO82H, SER136I, SER234I, SER270I, SER329H, SER332H, SER343H, SER403H, SER433H, SER88I, SER8I, THR120I, THR16I, THR183I, THR228I, THR244I, THR275I, THR377H, THR448H, THR45H, THR46H, THR471H, THR492H, THR509H, THR86H, TRP175I, TRP260I, TRP308H, TRP378H, TRP84I, TYR141I, TYR150I, TYR166I, TYR252I, TYR258I, TYR317H, TYR325H, TYR381H, TYR400H, TYR470H, TYR472H, TYR94H, VAL134I, VAL138I, VAL174I, VAL230I, VAL232I, VAL247I, VAL268I, VAL277I, VAL298H, VAL301H, VAL306H, VAL316H, VAL319H, VAL327H, VAL34I, VAL35I, VAL442H, VAL468H, VAL498H, VAL4I, VAL504H, VAL79H, VAL81I, VAL84H
• H-D: ALA103D, ALA150D, ALA402H, ALA404H, ALA408H, ALA50D, ALA73D, ALA85D, ARG139D, ARG146D, ARG47D, ARG75D, ASN95D, ASP158D, ASP397H, ASP398H, ASP406H, ASP514H, GLN412H, GLN82D, GLU401H, GLU53D, GLU74D, GLY104D, GLY407H, GLY409H, GLY51D, GLY76D, GLY78D, GLY99D, HIS89D, ILE395H, ILE417H, ILE423H, ILE49D, LEU100D, LEU102D, LEU156D, LEU399H, LEU421H, LEU422H, LEU46D, LEU52D, LEU86D, LEU90D, LYS101D, LYS132D, LYS416H, LYS424H, LYS512H, MET405H, MET79D, MET96D, PHE155D, PHE513H, PHE81D, PHE98D, PRO152D, PRO396H, PRO420H, PRO71D, PRO72D, PRO88D, SER403H, SER83D, THR147D, THR418H, TYR400H, TYR84D, TYR87D, VAL154D, VAL77D, VAL80D
• I-C: ALA103C, ALA150C, ALA191I, ALA192I, ALA193I, ALA197I, ALA202I, ALA50C, ALA73C, ALA85C, ARG114I, ARG146C, ARG47C, ARG75C, ASN287I, ASN95C, ASP185I, ASP195I, GLN201I, GLN82C, GLU189I, GLU190I, GLU53C, GLU74C, GLY196I, GLY51C, GLY76C, GLY78C, GLY99C, HIS89C, ILE184I, LEU100C, LEU102C, LEU188I, LEU194I, LEU205I, LEU207I, LEU210I, LEU52C, LEU86C, LEU90C, LYS101C, LYS132C, MET79C, PHE81C, PHE98C, PRO131C, PRO209I, PRO71C, PRO72C, PRO88C, SER186I, SER187I, SER83C, THR147C, TRP13C, TYR180I, TYR84C, TYR87C, VAL206I, VAL286I, VAL77C, VAL80C
• I-D: ALA50D, ALA73D, ARG47D, ARG75D, ASN68D, ASP69D, GLN5I, GLU53D, GLU74D, GLY51D, ILE55D, LEU52D, LYS11D, LYS7I, MET3I, MET48D, MET67D, PRO6I, PRO71D, PRO72D, THR54D, THR70D, TRP13D, VAL4I
• C-D: ALA166C, ALA166D, ALA167C, ALA167D, ALA197D, ALA201D, ALA372C, ALA372D, ARG173C, ARG173D, ARG178C, ARG178D, ARG286C, ARG286D, ARG330C, ARG330D, ARG351C, ARG351D, ASN312C, ASN312D, ASN326C, ASN326D, ASN332C, ASN332D, ASP165C, ASP193C, ASP333C, ASP333D, GLN171C, GLN171D, GLN194C, GLN194D, GLN305C, GLN305D, GLN309C, GLN309D, GLN315C, GLN315D, GLN319C, GLN319D, GLN325D, GLN331C, GLN331D, GLU196C, GLU196D, GLU288C, GLU288D, GLU308C, GLU308D, GLU313C, GLU313D, GLU339C, GLU339D, GLU368C, GLU368D, GLY235C, GLY235D, GLY311C, GLY311D, GLY370C, GLY370D, HIS192C, HIS223C, HIS223D, HIS289C, HIS289D, HIS317C, HIS317D, ILE174C, ILE174D, ILE234C, ILE234D, LEU200C, LEU200D, LEU219C, LEU219D, LEU291C, LEU310C, LEU310D, LEU336C, LEU336D, LYS181C, LYS181D, LYS217D, LYS238C, LYS238D, MET198C, MET198D, PHE233C, PRO218C, PRO218D, PRO237C, PRO237D, PRO287C, PRO287D, PRO369C, PRO369D, SER177C, SER177D, SER236C, SER236D, SER38D, THR199C, THR199D, THR314C, THR314D, TYR222C, TYR222D, VAL170C, VAL170D, VAL195C, VAL195D, VAL306C, VAL306D, VAL307C, VAL307D, VAL328C, VAL334C, VAL334D, VAL335C, VAL335D, VAL371C, VAL371D