1QXO

crystal structure of chorismate synthase complexed with oxidized fmn and epsp

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: B-D
  • Int. Res.: 185
  • Norm. En. per Res.: -5.5727
• 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	-252.8593	-10.6087	-1316.47	-1579.9379	370	52	34	50079	0	103	109
A-C	-147.1004	-283.2043	-592.651	-1022.9557	188	21	12	22031	21	80	67
A-D	-62.9784	-154.6821	-151.465	-369.1255	90	13	3	6547	16	49	33
B-C	-48.215	-126.3039	-135.142	-309.6609	85	9	3	5811	11	49	33
B-D	-144.5347	-292.2547	-594.159	-1030.9484	185	26	12	21945	20	78	64
C-D	-245.6167	-17.8693	-1317.16	-1580.646	366	47	33	50149	2	103	107

Interface residues

• A-B: ALA111A, ALA111B, ALA133A, ALA133B, ALA16A, ALA16B, ALA241A, ALA241B, ALA244A, ALA244B, ALA246A, ALA246B, ALA252A, ALA252B, ALA264A, ALA264B, ALA333A, ALA333B, ALA377A, ALA377B, ALA6A, ALA6B, ARG107A, ARG107B, ARG120A, ARG120B, ARG125A, ARG130A, ARG130B, ARG139A, ARG139B, ARG196B, ARG237A, ARG237B, ARG242A, ARG242B, ARG267A, ARG267B, ARG286A, ARG286B, ARG287A, ARG287B, ARG2A, ARG2B, ARG307A, ARG307B, ARG382A, ARG382B, ASN126A, ASN126B, ASN251A, ASN251B, ASN289A, ASN289B, ASN290A, ASN290B, ASN300A, ASN300B, ASN387A, ASN387B, ASP112A, ASP112B, ASP122A, ASP122B, ASP123A, ASP123B, ASP210A, ASP210B, ASP212A, ASP212B, ASP236A, ASP236B, ASP240A, ASP240B, ASP274A, ASP274B, ASP324A, ASP324B, ASP383A, ASP383B, GLN206A, GLN206B, GLN234A, GLN234B, GLN245A, GLN245B, GLN271A, GLN271B, GLN302A, GLN302B, GLN360A, GLN360B, GLU129A, GLU129B, GLU135A, GLU135B, GLU168A, GLU168B, GLU219A, GLU219B, GLU257A, GLU257B, GLU263A, GLU263B, GLU275A, GLU275B, GLU295A, GLU295B, GLU326A, GLU326B, GLU329A, GLU329B, GLU361A, GLU361B, GLU364A, GLU364B, GLU8A, GLU8B, GLY109A, GLY109B, GLY115A, GLY115B, GLY116A, GLY116B, GLY165A, GLY165B, GLY166A, GLY166B, GLY211A, GLY211B, GLY215A, GLY215B, GLY216A, GLY216B, GLY228A, GLY228B, GLY230A, GLY230B, GLY255A, GLY255B, GLY259A, GLY259B, GLY261A, GLY261B, GLY265A, GLY265B, GLY269A, GLY269B, GLY283A, GLY283B, GLY292A, GLY292B, GLY293A, GLY293B, GLY296A, GLY296B, GLY297A, GLY297B, GLY301A, GLY301B, GLY308A, GLY308B, GLY7A, GLY7B, HIS105A, HIS105B, HIS110A, HIS110B, HIS328A, HIS328B, HIS381A, HIS381B, ILE103A, ILE103B, ILE117A, ILE117B, ILE169A, ILE169B, ILE17A, ILE17B, ILE207A, ILE207B, ILE214A, ILE214B, ILE250A, ILE250B, ILE276A, ILE276B, ILE313A, ILE313B, ILE325A, ILE325B, LEU113A, LEU113B, LEU124A, LEU124B, LEU128A, LEU128B, LEU229A, LEU229B, LEU239A, LEU239B, LEU243A, LEU243B, LEU260A, LEU260B, LEU277A, LEU277B, LEU291A, LEU291B, LEU316A, LEU316B, LEU320A, LEU320B, LEU343A, LEU343B, LEU4A, LEU4B, LYS118A, LYS118B, LYS167A, LYS167B, LYS238A, LYS238B, LYS254A, LYS254B, LYS268A, LYS268B, LYS280A, LYS280B, LYS311A, LYS311B, LYS318A, LYS318B, LYS332A, LYS332B, LYS365A, LYS365B, LYS380A, LYS380B, LYS386A, LYS386B, PHE121A, PHE121B, PHE164A, PHE164B, PHE253A, PHE253B, PHE258A, PHE258B, PHE262A, PHE262B, PHE294A, PHE294B, PHE366A, PHE366B, PRO106A, PRO106B, PRO108A, PRO108B, PRO226A, PRO226B, PRO312A, PRO312B, PRO314A, PRO314B, PRO319A, PRO319B, PRO330A, PRO330B, PRO340A, PRO340B, SER127A, SER127B, SER131A, SER131B, SER132A, SER132B, SER231A, SER231B, SER249A, SER249B, SER270A, SER270B, SER279A, SER279B, SER322A, SER322B, THR104A, THR104B, THR136A, THR136B, THR15A, THR213A, THR213B, THR285A, THR285B, THR288A, THR299A, THR299B, THR315A, THR315B, THR327A, THR327B, THR334B, THR356A, THR356B, THR385A, THR385B, THR5A, THR5B, TRP235A, TRP235B, TRP278A, TRP278B, TYR119A, TYR119B, TYR203A, TYR203B, TYR232A, TYR232B, TYR266A, TYR266B, TYR284A, TYR284B, TYR317A, TYR331A, TYR331B, TYR384A, TYR384B, TYR388A, TYR388B, TYR3A, TYR3B, VAL114A, VAL114B, VAL142A, VAL142B, VAL162A, VAL162B, VAL163A, VAL163B, VAL217A, VAL217B, VAL218A, VAL218B, VAL227A, VAL227B, VAL233A, VAL233B, VAL247A, VAL247B, VAL248A, VAL248B, VAL256A, VAL256B, VAL272A, VAL272B, VAL305A, VAL305B, VAL306A, VAL306B, VAL309A, VAL309B, VAL323A, VAL323B, VAL353A, VAL353B, VAL357A, VAL357B
• A-C: ALA16A, ALA16C, ALA23A, ALA23C, ALA29A, ALA29C, ALA377A, ALA6A, ALA6C, ALA70A, ALA70C, ALA90A, ALA90C, ARG101A, ARG101C, ARG120A, ARG120C, ARG125A, ARG125C, ARG130A, ARG130C, ARG13A, ARG13C, ARG2A, ARG2A5, ARG2C, ARG63A, ARG63C, ASN126A, ASN126C, ASN370A, ASN370C, ASN78A, ASN78C, ASP122C, ASP123A, ASP123C, ASP369A, ASP369C, ASP75A, ASP75C, ASP86A, ASP86C, ASP92A, ASP92C, ASP95A, ASP95C, CB9.228795.79966, GLU129A, GLU129C, GLU135A, GLU135C, GLU19A, GLU19C, GLU30A, GLU30C, GLU372A, GLU372C, GLU373A, GLU373C, GLU376A, GLU376C, GLU8A, GLU8C, GLU91A, GLU91C, GLU94C, GLY115A, GLY115C, GLY116A, GLY116C, GLY11A, GLY11C, GLY20A, GLY20C, GLY24A, GLY24C, GLY61A, GLY61C, GLY65A, GLY65C, GLY69A, GLY69C, GLY7A, GLY7C, HIS64A, HIS64C, HIS81A, HIS81C, ILE103A, ILE103C, ILE117A, ILE117C, ILE17A, ILE17C, ILE18A, ILE18C, ILE21A, ILE21C, ILE72A, ILE72C, ILE77A, ILE77C, ILE87A, ILE87C, ILE93A, ILE93C, LEU124A, LEU124C, LEU128A, LEU128C, LEU14A, LEU14C, LEU27A, LEU27C, LEU371A, LEU371C, LEU374A, LEU374C, LEU4A, LEU4C, LEU85A, LEU85C, LEU97A, LEU97C, LYS100A, LYS100C, LYS102A, LYS102C, LYS118A, LYS118C, LYS375A, LYS375C, LYS66A, LYS66C, LYS98A, LYS98C, PHE121A, PHE121C, PHE58A, PHE58C, PRO12A, PRO12C, PRO22A, PRO22C, PRO26C, PRO71A, PRO71C, SER127A, SER127C, SER131A, SER131C, SER367A, SER367C, SER368A, SER368C, SER60A, SER60C, SER89A, SER89C, SER99A, SER99C, THR15A, THR15C, THR28A, THR28C, THR59A, THR59C, THR5A, THR5C, THR67A, THR67C, THR68A, THR68C, THR73A, THR73C, TRP84A, TRP84C, TYR119A, TYR119C, TYR3A, TYR3C, VAL57A, VAL57C, VAL62A, VAL62C, VAL76A, VAL76C
• A-D: ALA23A, ALA23D, ALA377A, ALA377D, ALA70A, ALA70D, ARG237A, ARG237D, ARG242A, ARG242D, ARG2A, ARG2D, ASN370A, ASN370D, ASP236A, ASP236D, ASP369A, ASP369D, GLN234A, GLN234D, GLU19A, GLU19D, GLU364A, GLU364D, GLU372A, GLU372D, GLU373A, GLU373D, GLU376A, GLU376D, GLY20A, GLY20D, GLY228A, GLY228D, GLY230A, GLY230D, GLY69A, GLY69D, HIS381A, HIS381D, ILE17A, ILE17D, ILE18A, ILE18D, ILE21A, ILE21D, ILE362A, ILE362D, ILE72A, ILE72D, LEU229A, LEU229D, LEU363A, LEU363D, LEU374A, LEU374D, LYS238A, LYS238D, LYS365A, LYS365D, LYS375A, LYS375D, LYS380A, LYS380D, PHE366A, PHE366D, PRO22A, PRO22D, PRO71A, PRO71D, SER231A, SER231D, SER367A, SER367D, SER368A, SER368D, THR68A, THR68D, TRP235A, TRP235D, TYR232A, TYR232D, TYR384A, TYR384D, VAL227A, VAL227D, VAL233A, VAL233D, VAL378A, VAL378D
• B-C: ALA23B, ALA23C, ALA377B, ALA377C, ALA70B, ALA70C, ARG237B, ARG237C, ARG242B, ARG242C, ARG2B, ARG2C, ASN370B, ASN370C, ASP236B, ASP236C, ASP369B, ASP369C, GLN234B, GLN234C, GLU19B, GLU19C, GLU364B, GLU364C, GLU372B, GLU372C, GLU373B, GLU373C, GLU376B, GLU376C, GLY20B, GLY20C, GLY228B, GLY228C, GLY230B, GLY230C, GLY69B, GLY69C, HIS381B, HIS381C, ILE17B, ILE17C, ILE18B, ILE21B, ILE21C, ILE362B, ILE72B, LEU229B, LEU229C, LEU363B, LEU363C, LEU374B, LEU374C, LEU4C, LYS238B, LYS365B, LYS365C, LYS380B, LYS380C, PHE366B, PHE366C, PRO22B, PRO22C, PRO71B, PRO71C, SER231B, SER231C, SER367B, SER367C, SER368B, SER368C, THR68B, THR68C, TRP235B, TRP235C, TYR232B, TYR232C, TYR384B, TYR384C, VAL227B, VAL227C, VAL233B, VAL233C, VAL378B, VAL378C
• B-D: ALA16B, ALA16D, ALA23B, ALA23D, ALA29B, ALA29D, ALA6B, ALA6D, ALA70B, ALA70D, ALA90B, ALA90D, ARG101B, ARG101D, ARG120B, ARG120D, ARG125B, ARG125D, ARG130B, ARG130D, ARG13B, ARG13D, ARG2B, ARG2D, ARG63B, ARG63D, ASN126B, ASN126D, ASN370B, ASN370D, ASN78B, ASN78D, ASP122B, ASP122D, ASP123B, ASP123D, ASP369B, ASP369D, ASP75B, ASP75D, ASP86B, ASP86D, ASP92B, ASP92D, ASP95B, ASP95D, GLU129B, GLU129D, GLU135B, GLU135D, GLU19B, GLU19D, GLU30B, GLU372B, GLU372D, GLU373B, GLU373D, GLU376B, GLU376D, GLU8B, GLU8D, GLU91B, GLU91D, GLU94B, GLY115B, GLY115D, GLY116B, GLY116D, GLY11B, GLY11D, GLY20B, GLY20D, GLY24B, GLY24D, GLY61B, GLY61D, GLY65B, GLY65D, GLY69B, GLY69D, GLY7B, GLY7D, HIS64B, HIS64D, HIS81B, HIS81D, ILE103B, ILE103D, ILE117B, ILE117D, ILE17B, ILE17D, ILE18B, ILE18D, ILE21B, ILE21D, ILE72B, ILE72D, ILE77B, ILE77D, ILE87B, ILE87D, ILE93B, ILE93D, LEU124B, LEU124D, LEU128B, LEU128D, LEU14B, LEU14D, LEU27B, LEU27D, LEU371B, LEU371D, LEU374B, LEU374D, LEU4B, LEU4D, LEU85B, LEU85D, LEU97B, LEU97D, LYS100B, LYS100D, LYS102B, LYS102D, LYS118B, LYS118D, LYS375B, LYS375D, LYS66B, LYS66D, LYS98B, LYS98D, PHE121B, PHE121D, PHE58B, PHE58D, PRO12B, PRO12D, PRO22B, PRO22D, PRO26D, PRO71B, PRO71D, SER127B, SER127D, SER131B, SER131D, SER367B, SER367D, SER368B, SER368D, SER60B, SER60D, SER89B, SER89D, SER99B, SER99D, THR15B, THR15D, THR28B, THR28D, THR59B, THR59D, THR5B, THR5D, THR67B, THR67D, THR68B, THR68D, THR73B, THR73D, TRP84B, TRP84D, TYR119B, TYR119D, TYR3B, TYR3D, VAL57B, VAL57D, VAL62B, VAL62D, VAL76B, VAL76D
• C-D: ALA111C, ALA111D, ALA133C, ALA133D, ALA16C, ALA16D, ALA241C, ALA241D, ALA244C, ALA244D, ALA246C, ALA246D, ALA252C, ALA252D, ALA264C, ALA264D, ALA333C, ALA333D, ALA377C, ALA377D, ALA6C, ALA6D, ARG107C, ARG107D, ARG120C, ARG120D, ARG125C, ARG125D, ARG130C, ARG130D, ARG139C, ARG139D, ARG209C, ARG237C, ARG237D, ARG242C, ARG242D, ARG267C, ARG267D, ARG286C, ARG286D, ARG287C, ARG287D, ARG2C, ARG2D, ARG307C, ARG307D, ARG382C, ARG382D, ASN126C, ASN126D, ASN251C, ASN251D, ASN289C, ASN289D, ASN290C, ASN290D, ASN300C, ASN300D, ASN387C, ASN387D, ASP112C, ASP112D, ASP122C, ASP122D, ASP123C, ASP123D, ASP210C, ASP210D, ASP212C, ASP212D, ASP236C, ASP236D, ASP240C, ASP240D, ASP274C, ASP274D, ASP324C, ASP324D, ASP383C, ASP383D, GLN206C, GLN206D, GLN234C, GLN234D, GLN245C, GLN245D, GLN271C, GLN271D, GLN302C, GLN302D, GLN360C, GLN360D, GLU129C, GLU129D, GLU135C, GLU135D, GLU168C, GLU168D, GLU219C, GLU219D, GLU257C, GLU257D, GLU263C, GLU263D, GLU275C, GLU275D, GLU295C, GLU295D, GLU326C, GLU326D, GLU329C, GLU329D, GLU361C, GLU361D, GLU364C, GLU8C, GLU8D, GLY109C, GLY109D, GLY115C, GLY115D, GLY116C, GLY116D, GLY165C, GLY165D, GLY166C, GLY166D, GLY211C, GLY211D, GLY215C, GLY215D, GLY216C, GLY216D, GLY228C, GLY228D, GLY230C, GLY230D, GLY255C, GLY255D, GLY259C, GLY259D, GLY261C, GLY261D, GLY265C, GLY265D, GLY269C, GLY269D, GLY283C, GLY283D, GLY292C, GLY292D, GLY293C, GLY293D, GLY296C, GLY296D, GLY297C, GLY297D, GLY301C, GLY301D, GLY308C, GLY308D, GLY7C, GLY7D, HIS105C, HIS105D, HIS110C, HIS110D, HIS328C, HIS328D, HIS381C, HIS381D, ILE117C, ILE117D, ILE17C, ILE17D, ILE207C, ILE207D, ILE214C, ILE214D, ILE250C, ILE250D, ILE276C, ILE276D, ILE313C, ILE313D, ILE325C, ILE325D, LEU113C, LEU113D, LEU124C, LEU124D, LEU128C, LEU128D, LEU229C, LEU229D, LEU239C, LEU239D, LEU243C, LEU243D, LEU260C, LEU260D, LEU277C, LEU277D, LEU291C, LEU291D, LEU316C, LEU316D, LEU320C, LEU320D, LEU343C, LEU343D, LEU4C, LEU4D, LYS118C, LYS118D, LYS167C, LYS167D, LYS208C, LYS238C, LYS238D, LYS254C, LYS254D, LYS268C, LYS268D, LYS280C, LYS280D, LYS311C, LYS311D, LYS318C, LYS318D, LYS332C, LYS332D, LYS365C, LYS365D, LYS380C, LYS380D, LYS386C, LYS386D, PHE121C, PHE121D, PHE164C, PHE164D, PHE253C, PHE253D, PHE258C, PHE258D, PHE262C, PHE262D, PHE294C, PHE294D, PHE366C, PHE366D, PRO106C, PRO106D, PRO108C, PRO108D, PRO226C, PRO226D, PRO312C, PRO312D, PRO314C, PRO314D, PRO319C, PRO319D, PRO330C, PRO330D, PRO340C, PRO340D, SER127C, SER127D, SER131C, SER131D, SER132C, SER132D, SER231C, SER231D, SER249C, SER249D, SER270C, SER270D, SER279C, SER279D, SER322C, SER322D, THR104C, THR104D, THR136C, THR136D, THR213C, THR213D, THR285C, THR285D, THR288D, THR299C, THR299D, THR315C, THR315D, THR327C, THR327D, THR334C, THR334D, THR356C, THR356D, THR385C, THR385D, THR5C, THR5D, TRP235C, TRP235D, TRP278C, TRP278D, TYR119C, TYR119D, TYR203C, TYR203D, TYR232C, TYR232D, TYR266C, TYR266D, TYR284C, TYR284D, TYR331C, TYR331D, TYR384C, TYR384D, TYR388C, TYR388D, TYR3C, TYR3D, VAL114C, VAL114D, VAL142C, VAL142D, VAL162C, VAL162D, VAL163C, VAL163D, VAL217C, VAL217D, VAL218C, VAL218D, VAL227C, VAL227D, VAL233C, VAL233D, VAL247C, VAL247D, VAL248C, VAL248D, VAL256C, VAL256D, VAL272C, VAL272D, VAL305C, VAL305D, VAL306C, VAL306D, VAL309C, VAL309D, VAL323C, VAL323D, VAL353C, VAL353D, VAL357C, VAL357D