2REQ

methylmalonyl-coa mutase, non-productive coa complex, in open conformation representing substrate-free state

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 436
  • Norm. En. per Res.: -4.7753
• Hub Node: A(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
A-B	-311.684	-254.2723	-1516.08	-2082.0362	436	61	51	58666	18	108	104
A-C	0.0	-1.6519	-29.7885	-31.4404	38	0	1	1430	0	35	34
B-C	0.0	0.0	-8.221	-8.221	18	0	0	514	0	7	3
C-D	-278.5605	-243.5503	-1543.75	-2065.8608	442	57	51	59056	18	108	104

Interface residues

• A-B: ALA106B, ALA107A, ALA108A, ALA15A, ALA19A, ALA21A, ALA22A, ALA24B, ALA257B, ALA260B, ALA265B, ALA273B, ALA295B, ALA299B, ALA29A, ALA303A, ALA303B, ALA304A, ALA305B, ALA309A, ALA30A, ALA30B, ALA32A, ALA346B, ALA352A, ALA354A, ALA379B, ALA37A, ALA383A, ALA387B, ALA399B, ALA407A, ALA413B, ALA415B, ALA416B, ALA417A, ALA420A, ALA462B, ALA471B, ALA65A, ALA76A, ALA80A, ALA81B, ALA91B, ARG100B, ARG104A, ARG131B, ARG23A, ARG24A, ARG264B, ARG298B, ARG301B, ARG302A, ARG305A, ARG306B, ARG318B, ARG342B, ARG347A, ARG377B, ARG37B, ARG380B, ARG381A, ARG384A, ARG394B, ARG398A, ARG410B, ARG418A, ARG456A, ARG456B, ARG45B, ARG461A, ARG471A, ARG472B, ARG47B, ARG521B, ARG522B, ARG61B, ARG6A, ARG77B, ARG82A, ARG95B, ASN101B, ASN105A, ASN14A, ASN293A, ASN339B, ASN343A, ASN344A, ASN381B, ASN385A, ASN391B, ASN396B, ASN44B, ASN468A, ASN51A, ASP103B, ASP105B, ASP11A, ASP20A, ASP248B, ASP26B, ASP289B, ASP316B, ASP335B, ASP340A, ASP369A, ASP373B, ASP377A, ASP397B, ASP401A, ASP414B, ASP415A, ASP493B, ASP523B, ASP53A, ASP57A, ASP59A, ASP62A, ASP71B, ASP8A, CYS349A, CYS58B, GLN110A, GLN269B, GLN290B, GLN314A, GLN339A, GLN34B, GLN357A, GLN387A, GLN391A, GLN392A, GLN421B, GLN425A, GLN458B, GLN462A, GLU127B, GLU130B, GLU261B, GLU268B, GLU26A, GLU27A, GLU297A, GLU302B, GLU309B, GLU315B, GLU32B, GLU330B, GLU334B, GLU33B, GLU351A, GLU36A, GLU36B, GLU388B, GLU389B, GLU38B, GLU393A, GLU39A, GLU406B, GLU40B, GLU410A, GLU422B, GLU424B, GLU426A, GLU465B, GLU473A, GLU475A, GLU52A, GLY102B, GLY109A, GLY128B, GLY132B, GLY13A, GLY259B, GLY25B, GLY270B, GLY291A, GLY308B, GLY312B, GLY33A, GLY343B, GLY353B, GLY35A, GLY383B, GLY393B, GLY395A, GLY400B, GLY401B, GLY405A, GLY422A, GLY427B, GLY428B, GLY460A, GLY466A, GLY46B, GLY470B, GLY47A, GLY525B, GLY526B, GLY66A, GLY86B, GLY89B, GLY96B, HIS288B, HIS313A, HIS359A, HIS423A, HIS474A, HIS65B, HIS72A, ILE294B, ILE307B, ILE340B, ILE345B, ILE350A, ILE378B, ILE382A, ILE384B, ILE392B, ILE400A, ILE424A, ILE44A, ILE460B, ILE465A, ILE469B, ILE474B, ILE67A, ILE70B, ILE72B, ILE86A, LEU106A, LEU129B, LEU12A, LEU21B, LEU23B, LEU256B, LEU266B, LEU28A, LEU292B, LEU300B, LEU307A, LEU311A, LEU331B, LEU336A, LEU341B, LEU368A, LEU386B, LEU388A, LEU390A, LEU408B, LEU412A, LEU412B, LEU416A, LEU426B, LEU43B, LEU464A, LEU472A, LEU49A, LEU4A, LEU53B, LEU59B, LEU61A, LEU62B, LEU85B, LYS29B, LYS310A, LYS31A, LYS418B, LYS419A, LYS41B, LYS425B, LYS431B, LYS457B, LYS469A, LYS56A, LYS79B, LYS83B, LYS84B, MET104B, MET256A, MET292A, MET296A, MET306A, MET323A, MET353A, MET429B, MET468B, MET58A, MET75B, MET78A, PHE25A, PHE271B, PHE277B, PHE27B, PHE291B, PHE294A, PHE295A, PHE311B, PHE348B, PHE363B, PHE374B, PHE378A, PHE389A, PHE420B, PHE466B, PHE50A, PHE524B, PHE55B, PHE70A, PHE7A, PHE81A, PHE93B, PRO16A, PRO18A, PRO18B, PRO28B, PRO317A, PRO320A, PRO336B, PRO398B, PRO402A, PRO459B, PRO463A, PRO467B, PRO476A, PRO5A, PRO68A, PRO69A, PRO74A, PRO74B, PRO78B, PRO82B, PRO88B, PRO92B, SER22B, SER335A, SER344B, SER349B, SER351B, SER379A, SER394A, SER402B, SER404A, SER406A, SER407B, SER430B, SER464B, SER473B, SER9A, THR134B, THR17B, THR19B, THR20B, THR287B, THR293B, THR31B, THR332B, THR337A, THR347B, THR348A, THR34A, THR356A, THR360B, THR365A, THR376A, THR382B, THR386A, THR396A, THR397A, THR409B, THR40A, THR413A, THR461B, THR48A, THR520B, THR63A, THR63B, THR66B, THR77A, THR94B, THR97B, THR98B, TRP107B, TRP304B, TRP308A, TRP35B, TRP38A, TRP403A, TRP414A, TRP417B, TRP421A, TRP60A, TYR337B, TYR342A, TYR403B, TYR404B, TYR408A, TYR470A, TYR55A, TYR64A, TYR75A, TYR76B, TYR79A, TYR87B, VAL109B, VAL10A, VAL133B, VAL17A, VAL263B, VAL267B, VAL298A, VAL310B, VAL312A, VAL338B, VAL341A, VAL345A, VAL346A, VAL352B, VAL385B, VAL390B, VAL395B, VAL399A, VAL39B, VAL405B, VAL409A, VAL423B, VAL42B, VAL463B, VAL467A, VAL46A, VAL54A, VAL64B, VAL71A, VAL73B, VAL90B, VAL99B
• A-C: ALA19A, ALA21A, ALA22A, ALA724C, ALA728C, ARG23A, ARG24A, ARG669C, ARG677C, ARG697C, ASP20A, ASP53A, ASP57A, ASP62A, ASP673C, GLU26A, GLU27A, GLU52A, GLU671C, GLY676C, GLY700C, LEU61A, LEU672C, LEU675C, LEU681C, LYS56A, LYS670C, LYS674C, LYS698C, LYS721C, PRO18A, PRO45A, PRO678C, SER725C, TYR55A, VAL17A, VAL645C, VAL702C
• B-C: ALA728C, ARG677C, ARG697C, ASP673C, ASP679C, ASP694C, GLY676C, ILE680C, LEU675C, LYS698C, LYS721C, LYS83B, LYS84B, PRO678C, PRO78B, THR19B, THR20B, TYR87B
• C-D: ALA106D, ALA107C, ALA108C, ALA15C, ALA19C, ALA21C, ALA22C, ALA24D, ALA257D, ALA260D, ALA265D, ALA273D, ALA295D, ALA299D, ALA29C, ALA303C, ALA303D, ALA304C, ALA305D, ALA309C, ALA30C, ALA30D, ALA32C, ALA346D, ALA352C, ALA354C, ALA379D, ALA37C, ALA383C, ALA387D, ALA399D, ALA407C, ALA413D, ALA415D, ALA416D, ALA417C, ALA41C, ALA420C, ALA462D, ALA471D, ALA65C, ALA76C, ALA80C, ALA81D, ALA91D, ARG100D, ARG104C, ARG131D, ARG23C, ARG24C, ARG264D, ARG298D, ARG301D, ARG302C, ARG305C, ARG306D, ARG318D, ARG342D, ARG347C, ARG377D, ARG37D, ARG380D, ARG381C, ARG384C, ARG394D, ARG398C, ARG410D, ARG418C, ARG452D, ARG456C, ARG456D, ARG45D, ARG461C, ARG471C, ARG472D, ARG47D, ARG521D, ARG522D, ARG61D, ARG6C, ARG77D, ARG82C, ARG95D, ASN101D, ASN105C, ASN14C, ASN293C, ASN339D, ASN343C, ASN344C, ASN381D, ASN385C, ASN391D, ASN396D, ASN44D, ASN468C, ASN51C, ASP103D, ASP105D, ASP11C, ASP20C, ASP248D, ASP253C, ASP26D, ASP289D, ASP316D, ASP335D, ASP340C, ASP369C, ASP373D, ASP377C, ASP397D, ASP401C, ASP414D, ASP415C, ASP493D, ASP523D, ASP53C, ASP57C, ASP59C, ASP62C, ASP71D, ASP8C, CYS349C, CYS58D, GLN110C, GLN269D, GLN290D, GLN314C, GLN34D, GLN357C, GLN387C, GLN391C, GLN392C, GLN421D, GLN425C, GLN458D, GLN462C, GLU127D, GLU130D, GLU261D, GLU268D, GLU26C, GLU27C, GLU297C, GLU302D, GLU309D, GLU315D, GLU32D, GLU330D, GLU334D, GLU33D, GLU351C, GLU36C, GLU36D, GLU388D, GLU389D, GLU38D, GLU393C, GLU39C, GLU406D, GLU40D, GLU410C, GLU422D, GLU424D, GLU426C, GLU465D, GLU473C, GLU475C, GLU528D, GLU52C, GLU546D, GLY102D, GLY109C, GLY128D, GLY132D, GLY13C, GLY25D, GLY270D, GLY291C, GLY308D, GLY312D, GLY33C, GLY343D, GLY353D, GLY35C, GLY383D, GLY393D, GLY395C, GLY400D, GLY401D, GLY405C, GLY422C, GLY427D, GLY428D, GLY460C, GLY466C, GLY470D, GLY47C, GLY525D, GLY526D, GLY66C, GLY86D, GLY89D, GLY96D, HIS288D, HIS313C, HIS359C, HIS423C, HIS474C, HIS65D, HIS72C, ILE294D, ILE307D, ILE340D, ILE345D, ILE350C, ILE378D, ILE382C, ILE384D, ILE392D, ILE400C, ILE424C, ILE44C, ILE460D, ILE465C, ILE469D, ILE474D, ILE67C, ILE70D, ILE72D, ILE86C, LEU106C, LEU129D, LEU12C, LEU21D, LEU23D, LEU256D, LEU266D, LEU28C, LEU292D, LEU300D, LEU307C, LEU311C, LEU336C, LEU341D, LEU368C, LEU386D, LEU388C, LEU390C, LEU408D, LEU412C, LEU412D, LEU416C, LEU426D, LEU43D, LEU453D, LEU464C, LEU472C, LEU49C, LEU4C, LEU53D, LEU59D, LEU61C, LEU62D, LEU85D, LYS29D, LYS310C, LYS31C, LYS418D, LYS419C, LYS41D, LYS425D, LYS431D, LYS457D, LYS469C, LYS56C, LYS79D, LYS83D, LYS84D, MET104D, MET256C, MET292C, MET296C, MET306C, MET323C, MET353C, MET429D, MET468D, MET58C, MET75D, MET78C, PHE25C, PHE271D, PHE277D, PHE27D, PHE291D, PHE294C, PHE295C, PHE311D, PHE348D, PHE363D, PHE374D, PHE378C, PHE389C, PHE420D, PHE466D, PHE50C, PHE524D, PHE55D, PHE70C, PHE7C, PHE81C, PHE93D, PRO16C, PRO18C, PRO18D, PRO28D, PRO317C, PRO320C, PRO336D, PRO375D, PRO398D, PRO402C, PRO459D, PRO463C, PRO467D, PRO476C, PRO5C, PRO68C, PRO69C, PRO74C, PRO74D, PRO78D, PRO82D, PRO88D, PRO92D, SER22D, SER335C, SER344D, SER349D, SER351D, SER379C, SER394C, SER402D, SER404C, SER406C, SER407D, SER430D, SER464D, SER473D, SER9C, THR134D, THR17D, THR19D, THR20D, THR272D, THR287D, THR293D, THR31D, THR332D, THR337C, THR347D, THR348C, THR34C, THR356C, THR360D, THR365C, THR376C, THR382D, THR386C, THR396C, THR397C, THR409D, THR40C, THR413C, THR461D, THR48C, THR520D, THR63C, THR63D, THR66D, THR77C, THR94D, THR97D, THR98D, TRP107D, TRP304D, TRP308C, TRP35D, TRP38C, TRP403C, TRP414C, TRP417D, TRP421C, TRP60C, TYR337D, TYR342C, TYR403D, TYR404D, TYR408C, TYR470C, TYR55C, TYR64C, TYR75C, TYR76D, TYR79C, TYR87D, VAL109D, VAL10C, VAL133D, VAL17C, VAL263D, VAL267D, VAL298C, VAL310D, VAL312C, VAL313D, VAL338D, VAL341C, VAL345C, VAL346C, VAL352D, VAL385D, VAL390D, VAL395D, VAL399C, VAL39D, VAL405D, VAL409C, VAL423D, VAL42D, VAL463D, VAL467C, VAL46C, VAL54C, VAL64D, VAL67D, VAL71C, VAL73D, VAL90D, VAL99D