1S00

photosynthetic reaction center double mutant from rhodobacter sphaeroides with asp l213 replaced with asn and arg m233 replaced with cys in the charge-separated d+qaqb- state

• Total interactions analyzed: 15
• Total true interactions: 6
• Strongest Interaction:
  • Chains: L-M
  • Int. Res.: 339
  • Norm. En. per Res.: -5.5431
• Hub Node: R(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
L-M	-220.2639	-138.0199	-1520.84	-1879.1238	339	85	52	55993	11	54	66
L-H	-124.5309	-3.2712	-428.48	-556.2821	166	23	8	17346	3	52	46
M-H	-114.049	-30.3241	-716.244	-860.6171	242	48	19	28768	7	66	66
R-S	-191.7173	-135.6432	-1491.43	-1818.7904	339	88	52	55647	10	53	67
R-T	-125.0843	-13.7083	-415.467	-554.2596	164	28	8	17117	3	52	44
S-T	-94.9304	-4.9246	-699.603	-799.458	233	51	20	28721	3	61	62

Interface residues

• L-M: ALA101L, ALA120L, ALA124L, ALA137M, ALA139M, ALA147M, ALA149M, ALA153M, ALA16M, ALA176L, ALA184L, ALA186L, ALA188L, ALA192L, ALA197L, ALA198L, ALA1L, ALA213M, ALA217M, ALA221M, ALA225M, ALA239M, ALA240L, ALA244M, ALA245M, ALA248M, ALA249M, ALA260M, ALA269M, ALA273L, ALA273M, ALA45M, ALA78M, ALA83M, ARG103L, ARG109L, ARG10L, ARG132M, ARG136M, ARG207L, ARG217L, ARG228M, ARG231L, ARG241M, ARG247M, ARG253M, ARG267M, ARG29M, ARG7L, ARG87M, ASN159L, ASN166L, ASN170L, ASN183L, ASN187M, ASN188M, ASN195M, ASN199L, ASN199M, ASN213L, ASN259M, ASN25M, ASN274L, ASN280L, ASN28M, ASN44M, ASN5M, ASN81M, ASP155L, ASP17M, ASP184M, ASP210L, ASP218L, ASP23M, ASP240M, ASP261L, ASP88M, CYS108L, CYS233M, GLN11M, GLN138M, GLN237M, GLN264L, GLN46M, GLN4M, GLN62L, GLN77M, GLN9M, GLU104L, GLU106L, GLU201L, GLU205L, GLU212L, GLU22M, GLU232M, GLU234M, GLU236M, GLU246M, GLU263M, GLU2M, GLU6L, GLY112L, GLY114L, GLY131M, GLY13L, GLY141M, GLY143M, GLY14L, GLY161L, GLY165L, GLY191L, GLY19M, GLY203M, GLY211M, GLY220M, GLY221L, GLY225L, GLY228L, GLY230M, GLY231M, GLY233L, GLY242M, GLY257M, GLY264M, GLY277L, GLY278L, GLY27L, GLY281L, GLY298M, GLY33M, GLY40M, GLY43M, GLY48M, GLY53M, GLY56M, GLY79M, HIS116L, HIS145M, HIS153L, HIS168L, HIS173L, HIS182M, HIS190L, HIS202M, HIS211L, HIS219M, HIS230L, HIS266M, HIS301M, ILE107L, ILE113L, ILE117L, ILE177L, ILE179M, ILE206M, ILE223M, ILE224L, ILE229L, ILE238M, ILE265M, ILE270M, ILE275L, ILE279L, ILE50M, ILE6M, LEU111L, LEU135M, LEU140M, LEU154L, LEU156M, LEU183M, LEU185L, LEU187L, LEU189L, LEU18M, LEU191M, LEU193L, LEU195L, LEU196M, LEU209M, LEU214M, LEU215M, LEU219L, LEU224M, LEU227L, LEU232L, LEU234L, LEU235L, LEU235M, LEU236L, LEU238L, LEU250M, LEU269L, LEU26M, LEU275M, LEU2L, LEU39M, LEU3L, LEU47M, LEU52M, LEU86M, LEU89M, LYS110L, LYS144M, LYS202L, LYS204L, LYS268L, LYS8L, MET142M, MET174L, MET206L, MET20M, MET218M, MET256M, MET262M, MET272M, PHE119L, PHE121L, PHE123L, PHE150M, PHE167L, PHE179L, PHE180L, PHE180M, PHE181L, PHE189M, PHE197M, PHE208M, PHE215L, PHE216L, PHE216M, PHE229M, PHE251M, PHE258M, PHE29L, PHE35M, PHE42M, PHE5L, PHE74M, PHE7M, PHE85M, PHE90M, PHE91M, PHE92M, PRO118L, PRO171L, PRO200L, PRO200M, PRO209L, PRO276L, PRO28L, PRO34M, PRO49M, PRO82M, SER152M, SER158L, SER178L, SER181M, SER190M, SER196L, SER205M, SER212M, SER223L, SER227M, SER237L, SER239L, SER244L, SER30M, SER36M, SER4L, SER8M, SER93M, THR133M, THR146M, THR160L, THR182L, THR186M, THR208L, THR214L, THR21M, THR222M, THR226L, THR243M, THR255M, THR261M, THR277M, THR38L, TRP100L, TRP129M, TRP130M, TRP148M, TRP151L, TRP156L, TRP185M, TRP252M, TRP254M, TRP25L, TRP262L, TRP263L, TRP265L, TRP266L, TRP268M, TRP271L, TRP271M, TRP272L, TRP297M, TRP41M, TRP73M, TRP75M, TRP80M, TYR115L, TYR134M, TYR162L, TYR169L, TYR198M, TYR210M, TYR222L, TYR295M, TYR30L, TYR3M, TYR51M, TYR76M, TYR9L, VAL105L, VAL11L, VAL157L, VAL194L, VAL220L, VAL226M, VAL241L, VAL24M, VAL260L, VAL267L, VAL26L, VAL274M, VAL276M, VAL31L, VAL32M, VAL84M
• L-H: ALA112H, ALA116H, ALA176H, ALA197L, ALA198L, ALA1L, ALA238H, ALA245H, ALA50H, ALA51H, ALA86H, ALA88H, ALA91H, ALA99H, ARG109L, ARG10L, ARG177H, ARG207L, ARG217L, ARG231L, ARG248H, ARG37H, ARG70H, ARG7L, ARG83H, ARG89H, ASN199L, ASN206H, ASN20L, ASN213L, ASN35H, ASN44H, ASN52H, ASP107H, ASP124H, ASP170H, ASP210L, ASP231H, ASP23L, ASP46H, CYS108L, GLN174H, GLN194H, GLN32H, GLN53H, GLU106L, GLU122H, GLU173H, GLU201L, GLU205L, GLU212L, GLU34H, GLU38H, GLU43H, GLU45H, GLU6L, GLU79H, GLU81H, GLU94H, GLY108H, GLY110H, GLY112L, GLY114L, GLY125H, GLY127H, GLY13L, GLY14L, GLY203L, GLY225L, GLY228L, GLY235H, GLY239H, GLY240H, GLY27L, GLY39H, GLY47H, GLY69H, GLY71H, GLY77H, GLY95H, HIS116L, HIS126H, HIS128H, HIS211L, HIS68H, HIS98H, ILE107L, ILE113L, ILE171H, ILE224L, ILE229L, ILE65H, ILE85H, LEU111L, LEU123H, LEU195L, LEU21L, LEU227L, LEU241H, LEU2L, LEU31H, LEU3L, LEU42H, LEU66H, LEU73H, LEU87H, LYS110L, LYS130H, LYS202L, LYS204L, LYS62H, LYS8L, MET175H, MET193H, MET195H, MET206L, MET242H, MET36H, PHE22L, PHE24L, PHE29L, PHE5L, PHE64H, PHE96H, PRO100H, PRO104H, PRO111H, PRO12L, PRO172H, PRO200L, PRO209L, PRO28L, PRO41H, PRO49H, PRO67H, PRO78H, PRO84H, PRO97H, SER113H, SER223L, SER4L, SER80H, THR101H, THR15L, THR208L, THR214L, THR226L, THR48H, THR63H, THR72H, THR90H, TRP114H, TRP25L, TYR115L, TYR243H, TYR30H, TYR30L, TYR40H, TYR9L, VAL109H, VAL115H, VAL11L, VAL194L, VAL237H, VAL26L, VAL31L
• M-H: ALA112H, ALA116H, ALA137H, ALA138H, ALA13H, ALA144H, ALA16H, ALA16M, ALA176H, ALA1M, ALA207H, ALA207M, ALA225M, ALA238H, ALA239M, ALA244M, ALA245M, ALA249M, ALA254H, ALA260M, ALA269M, ALA45M, ARG117H, ARG118H, ARG13M, ARG177H, ARG202H, ARG228M, ARG241M, ARG247M, ARG248H, ARG253M, ARG267M, ARG29M, ARG37H, ARG70H, ARG83H, ASN147H, ASN199M, ASN206H, ASN259M, ASN300M, ASN35H, ASN44M, ASN5M, ASP119H, ASP11H, ASP124H, ASP170H, ASP17M, ASP231H, ASP240M, ASP292M, CYS233M, CYS234H, GLN11M, GLN174H, GLN194H, GLN199H, GLN237M, GLN32H, GLN46M, GLN4M, GLN53H, GLN9M, GLU122H, GLU173H, GLU22M, GLU230H, GLU232M, GLU234M, GLU236M, GLU246M, GLU263M, GLU2M, GLU34H, GLU38H, GLU43H, GLU79H, GLU81H, GLY108H, GLY110H, GLY125H, GLY127H, GLY139H, GLY145H, GLY14M, GLY19M, GLY203M, GLY230M, GLY231M, GLY235H, GLY239H, GLY240H, GLY242M, GLY257M, GLY264M, GLY280M, GLY283M, GLY39H, GLY40M, GLY43M, GLY54H, GLY77H, HIS126H, HIS141H, HIS145M, HIS202M, HIS204H, HIS266M, HIS301M, HIS68H, ILE131H, ILE149H, ILE167H, ILE171H, ILE17H, ILE223M, ILE233H, ILE238M, ILE265M, ILE270M, ILE282M, ILE28H, ILE65H, LEU120H, LEU123H, LEU12H, LEU15H, LEU179H, LEU18M, LEU204M, LEU215M, LEU224M, LEU227H, LEU228H, LEU235M, LEU241H, LEU24H, LEU250M, LEU275M, LEU278M, LEU27H, LEU286M, LEU31H, LEU38M, LEU42H, LEU47M, LEU66H, LEU73H, LYS130H, LYS146H, LYS197H, LYS232H, LYS62H, MET134H, MET175H, MET193H, MET195H, MET20M, MET242H, MET256M, MET262M, MET272M, MET36H, PHE140H, PHE178H, PHE201M, PHE208M, PHE20H, PHE229M, PHE23H, PHE258M, PHE35M, PHE42M, PHE56H, PHE64H, PHE7M, PRO111H, PRO148H, PRO15M, PRO172H, PRO192H, PRO200M, PRO59H, PRO67H, PRO76H, PRO78H, SER113H, SER143H, SER14H, SER19H, SER205M, SER227M, SER287M, SER36M, SER80H, SER8M, THR21M, THR243M, THR261M, THR279M, THR289M, THR33H, THR37M, THR72H, TRP114H, TRP168H, TRP21H, TRP254M, TRP268M, TRP271M, TRP294M, TRP297M, TRP41M, TYR18H, TYR236H, TYR243H, TYR29H, TYR30H, TYR3M, TYR40H, VAL109H, VAL10M, VAL115H, VAL12M, VAL142H, VAL164H, VAL169H, VAL196H, VAL198H, VAL203H, VAL205H, VAL226M, VAL237H, VAL251H, VAL274M, VAL276M, VAL290M, VAL291M, VAL32M, VAL75H
• R-S: ALA101R, ALA120R, ALA124R, ALA137S, ALA139S, ALA147S, ALA149S, ALA153S, ALA16S, ALA176R, ALA184R, ALA186R, ALA188R, ALA192R, ALA197R, ALA198R, ALA1R, ALA213S, ALA217S, ALA221S, ALA225S, ALA239S, ALA240R, ALA244S, ALA245S, ALA248S, ALA249S, ALA260S, ALA269S, ALA273R, ALA273S, ALA45S, ALA78S, ALA83S, ARG103R, ARG109R, ARG10R, ARG132S, ARG136S, ARG207R, ARG217R, ARG228S, ARG231R, ARG241S, ARG247S, ARG253S, ARG267S, ARG29S, ARG7R, ARG87S, ASN159R, ASN166R, ASN170R, ASN183R, ASN187S, ASN188S, ASN195S, ASN199R, ASN199S, ASN213R, ASN259S, ASN25S, ASN274R, ASN280R, ASN28S, ASN44S, ASN5S, ASN81S, ASP155R, ASP17S, ASP184S, ASP210R, ASP218R, ASP23S, ASP240S, ASP261R, ASP88S, CYS108R, CYS233S, GLN11S, GLN138S, GLN237S, GLN264R, GLN299S, GLN46S, GLN4S, GLN62R, GLN77S, GLN9S, GLU104R, GLU106R, GLU201R, GLU205R, GLU212R, GLU22S, GLU232S, GLU234S, GLU236S, GLU246S, GLU263S, GLU6R, GLY112R, GLY114R, GLY131S, GLY13R, GLY141S, GLY143S, GLY14R, GLY161R, GLY165R, GLY191R, GLY19S, GLY203S, GLY211S, GLY220S, GLY221R, GLY225R, GLY228R, GLY230S, GLY231S, GLY233R, GLY242S, GLY257S, GLY264S, GLY277R, GLY278R, GLY27R, GLY281R, GLY298S, GLY33S, GLY40S, GLY43S, GLY48S, GLY53S, GLY56S, GLY79S, HIS116R, HIS145S, HIS153R, HIS168R, HIS173R, HIS182S, HIS190R, HIS202S, HIS211R, HIS219S, HIS230R, HIS266S, HIS301S, ILE107R, ILE113R, ILE117R, ILE177R, ILE179S, ILE206S, ILE223S, ILE224R, ILE229R, ILE238S, ILE265S, ILE270S, ILE275R, ILE279R, ILE50S, ILE6S, LEU111R, LEU135S, LEU140S, LEU154R, LEU156S, LEU183S, LEU185R, LEU187R, LEU189R, LEU18S, LEU191S, LEU193R, LEU195R, LEU196S, LEU209S, LEU214S, LEU215S, LEU219R, LEU224S, LEU227R, LEU232R, LEU234R, LEU235R, LEU235S, LEU236R, LEU238R, LEU250S, LEU269R, LEU26S, LEU275S, LEU2R, LEU39S, LEU3R, LEU47S, LEU52S, LEU63R, LEU86S, LEU89S, LYS110R, LYS144S, LYS202R, LYS204R, LYS268R, LYS8R, MET142S, MET174R, MET206R, MET20S, MET218S, MET256S, MET262S, MET272S, PHE119R, PHE121R, PHE123R, PHE150S, PHE167R, PHE179R, PHE180R, PHE180S, PHE181R, PHE189S, PHE197S, PHE208S, PHE215R, PHE216R, PHE216S, PHE229S, PHE251S, PHE258S, PHE29R, PHE35S, PHE42S, PHE5R, PHE74S, PHE7S, PHE85S, PHE90S, PHE91S, PHE92S, PRO118R, PRO171R, PRO200R, PRO200S, PRO209R, PRO276R, PRO28R, PRO34S, PRO49S, PRO82S, SER152S, SER158R, SER178R, SER181S, SER190S, SER196R, SER205S, SER212S, SER223R, SER227S, SER237R, SER239R, SER244R, SER30S, SER36S, SER4R, SER8S, SER93S, THR133S, THR146S, THR152R, THR182R, THR186S, THR208R, THR214R, THR21S, THR222S, THR226R, THR243S, THR255S, THR261S, THR277S, TRP100R, TRP129S, TRP130S, TRP148S, TRP151R, TRP156R, TRP185S, TRP252S, TRP254S, TRP25R, TRP262R, TRP263R, TRP265R, TRP266R, TRP268S, TRP271R, TRP271S, TRP272R, TRP294S, TRP297S, TRP41S, TRP73S, TRP75S, TRP80S, TYR115R, TYR134S, TYR162R, TYR169R, TYR198S, TYR210S, TYR222R, TYR30R, TYR3S, TYR51S, TYR76S, TYR9R, VAL105R, VAL11R, VAL157R, VAL194R, VAL220R, VAL226S, VAL241R, VAL24S, VAL260R, VAL267R, VAL26R, VAL274S, VAL276S, VAL31R, VAL32S, VAL84S
• R-T: ALA112T, ALA116T, ALA176T, ALA197R, ALA198R, ALA1R, ALA238T, ALA245T, ALA50T, ALA51T, ALA86T, ALA88T, ALA91T, ALA99T, ARG109R, ARG10R, ARG177T, ARG207R, ARG217R, ARG231R, ARG248T, ARG37T, ARG70T, ARG7R, ARG83T, ARG89T, ASN199R, ASN20R, ASN213R, ASN35T, ASN44T, ASN52T, ASP107T, ASP124T, ASP170T, ASP210R, ASP231T, ASP23R, ASP46T, CYS108R, CYS234T, GLN174T, GLN194T, GLN53T, GLU106R, GLU122T, GLU173T, GLU201R, GLU205R, GLU212R, GLU34T, GLU38T, GLU43T, GLU45T, GLU6R, GLU79T, GLU81T, GLU94T, GLY108T, GLY110T, GLY112R, GLY114R, GLY125T, GLY127T, GLY13R, GLY14R, GLY203R, GLY225R, GLY228R, GLY235T, GLY239T, GLY240T, GLY27R, GLY39T, GLY47T, GLY69T, GLY71T, GLY77T, GLY95T, HIS116R, HIS126T, HIS128T, HIS211R, HIS68T, HIS98T, ILE107R, ILE113R, ILE171T, ILE224R, ILE229R, ILE65T, ILE85T, LEU111R, LEU123T, LEU195R, LEU21R, LEU227R, LEU241T, LEU2R, LEU31T, LEU3R, LEU42T, LEU66T, LEU73T, LEU87T, LYS110R, LYS130T, LYS202R, LYS204R, LYS62T, LYS8R, MET175T, MET193T, MET195T, MET206R, MET242T, MET36T, PHE22R, PHE24R, PHE29R, PHE5R, PHE64T, PHE96T, PRO100T, PRO104T, PRO111T, PRO12R, PRO172T, PRO200R, PRO209R, PRO28R, PRO41T, PRO67T, PRO78T, PRO84T, PRO97T, SER113T, SER223R, SER4R, SER80T, SER93T, THR101T, THR15R, THR208R, THR214R, THR226R, THR48T, THR63T, THR72T, THR90T, TRP114T, TRP25R, TYR115R, TYR243T, TYR30R, TYR30T, TYR40T, TYR9R, VAL109T, VAL115T, VAL11R, VAL237T, VAL26R, VAL31R
• S-T: ALA112T, ALA116T, ALA137T, ALA138T, ALA13T, ALA144T, ALA16S, ALA16T, ALA176T, ALA207S, ALA207T, ALA225S, ALA238T, ALA239S, ALA244S, ALA245S, ALA249S, ALA260S, ALA269S, ALA45S, ARG117T, ARG118T, ARG13S, ARG177T, ARG202T, ARG228S, ARG241S, ARG247S, ARG253S, ARG267S, ARG29S, ARG37T, ARG70T, ARG83T, ASN147T, ASN199S, ASN206T, ASN259S, ASN300S, ASN35T, ASN44S, ASN5S, ASP119T, ASP11T, ASP124T, ASP170T, ASP17S, ASP231T, ASP240S, CYS233S, CYS234T, GLN11S, GLN174T, GLN194T, GLN199T, GLN237S, GLN32T, GLN46S, GLN4S, GLN53T, GLN9S, GLU122T, GLU173T, GLU22S, GLU230T, GLU232S, GLU234S, GLU236S, GLU246S, GLU263S, GLU34T, GLU38T, GLU43T, GLU79T, GLU81T, GLY108T, GLY110T, GLY125T, GLY127T, GLY139T, GLY145T, GLY14S, GLY19S, GLY203S, GLY230S, GLY231S, GLY235T, GLY239T, GLY240T, GLY242S, GLY257S, GLY264S, GLY283S, GLY298S, GLY39T, GLY40S, GLY43S, GLY54T, GLY77T, HIS126T, HIS141T, HIS145S, HIS202S, HIS204T, HIS266S, HIS301S, HIS68T, ILE131T, ILE149T, ILE167T, ILE171T, ILE17T, ILE223S, ILE233T, ILE238S, ILE265S, ILE270S, ILE282S, ILE28T, ILE65T, LEU120T, LEU123T, LEU12T, LEU15T, LEU179T, LEU18S, LEU204S, LEU215S, LEU224S, LEU227T, LEU228T, LEU235S, LEU241T, LEU24T, LEU250S, LEU275S, LEU278S, LEU27T, LEU286S, LEU31T, LEU38S, LEU42T, LEU66T, LEU73T, LYS130T, LYS132T, LYS146T, LYS197T, LYS232T, LYS62T, MET134T, MET175T, MET193T, MET195T, MET20S, MET242T, MET256S, MET262S, MET272S, MET36T, PHE140T, PHE178T, PHE201S, PHE208S, PHE20T, PHE229S, PHE23T, PHE258S, PHE35S, PHE42S, PHE56T, PHE64T, PHE7S, PRO111T, PRO148T, PRO15S, PRO172T, PRO192T, PRO200S, PRO59T, PRO67T, PRO76T, PRO78T, SER113T, SER143T, SER14T, SER19T, SER205S, SER227S, SER287S, SER36S, SER80T, SER8S, THR21S, THR243S, THR261S, THR279S, THR289S, THR33T, THR37S, THR72T, TRP114T, TRP168T, TRP21T, TRP254S, TRP268S, TRP271S, TRP294S, TRP297S, TRP41S, TYR18T, TYR236T, TYR243T, TYR29T, TYR30T, TYR3S, TYR40T, VAL109T, VAL10S, VAL115T, VAL12S, VAL142T, VAL164T, VAL169T, VAL196T, VAL198T, VAL203T, VAL226S, VAL237T, VAL274S, VAL290S, VAL291S, VAL75T