3ODM

archaeal-type phosphoenolpyruvate carboxylase

• Total interactions analyzed: 28
• Total true interactions: 14
• Strongest Interaction:
  • Chains: B-H
  • Int. Res.: 118
  • Norm. En. per Res.: -3.166
• Hub Node: C(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-C	0.0	-40.2734	-158.424	-198.6975	70	8	0	7151	3	29	38
A-E	-12.9657	-1.7382	-327.078	-341.7819	117	11	2	12548	0	16	17
B-C	0.0	-2.4755	-7.2898	-9.7653	13	0	0	417	0	10	2
B-G	0.0	-25.0081	-150.426	-175.4341	67	8	0	6869	2	30	35
B-H	-32.624	-14.3186	-326.647	-373.5895	118	15	1	12829	1	15	16
C-D	-20.3193	-12.9866	-315.602	-348.9079	118	13	1	12757	1	15	19
C-F	-9.6486	-23.5254	-53.339	-86.513	39	2	0	2460	2	14	13
C-G	-20.2576	-11.2483	-55.8494	-87.3553	47	1	0	2507	3	24	20
D-E	-10.831	-18.7768	-135.847	-165.4547	68	11	0	6824	3	29	34
D-F	-24.0034	-7.2769	-74.2256	-105.5059	47	2	0	2983	3	24	20
D-G	0.0	-6.9428	-5.0831	-12.0259	34	0	0	543	0	19	24
E-F	0.0	-4.0966	-5.5168	-9.6134	17	3	0	658	0	14	4
F-G	-27.8841	-15.4143	-327.997	-371.2954	118	17	2	12906	1	14	16
F-H	0.0	-32.4967	-152.406	-184.9027	68	3	0	6734	3	29	34

Interface residues

• A-C: ARG528A, ARG528C, ASN485A, ASN485C, ASN487A, ASN487C, GLU486A, GLU486C, GLU488A, GLU488C, GLU517A, GLU517C, GLU518A, GLU518C, GLU524A, GLU524C, GLY506A, GLY506C, HIS491A, HIS491C, HIS503A, HIS503C, ILE500A, ILE500C, ILE501A, ILE501C, ILE521A, ILE521C, LEU493A, LEU493C, LEU494A, LEU494C, LEU504A, LEU504C, LEU507A, LEU507C, LEU519A, LEU519C, LEU522A, LEU522C, LYS454A, LYS454C, LYS495A, LYS495C, LYS498A, LYS498C, LYS520A, LYS520C, LYS531A, LYS531C, MET502A, MET502C, PHE489A, PHE489C, PRO499A, PRO499C, SER515A, SER515C, THR492A, THR492C, THR496A, THR496C, THR497A, THR497C, TRP525A, TRP525C, TYR490A, TYR490C, VAL451A, VAL451C
• A-E: ALA86A, ARG137A, ARG137E, ARG342A, ARG342E, ARG344A, ARG344E, ARG93A, ARG93E, ASN146A, ASN146E, ASN148A, ASN148E, ASP143A, ASP143E, ASP343A, ASP343E, ASP48A, GLN107A, GLN107E, GLN22A, GLN22E, GLN23A, GLN23E, GLN58A, GLN58E, GLN61A, GLN61E, GLN94A, GLN94E, GLU103A, GLU103E, GLU24A, GLU24E, GLU50A, GLU50E, GLU89A, GLU89E, GLY145A, GLY145E, GLY51A, GLY51E, HIS57A, HIS57E, ILE101A, ILE101E, ILE102A, ILE102E, ILE19A, ILE19E, ILE21A, ILE21E, ILE98A, ILE98E, LEU153A, LEU153E, LEU345A, LEU345E, LEU53A, LEU53E, LEU64A, LEU95A, LEU95E, LYS147A, LYS147E, LYS52A, LYS52E, MET144A, MET144E, MET96A, MET96E, MET99A, MET99E, PHE49A, PHE49E, PHE92A, PHE92E, PRO25A, PRO25E, PRO55A, PRO55E, PRO84A, PRO84E, SER100A, SER100E, SER140A, SER140E, SER20A, SER20E, SER60A, SER60E, SER90A, SER90E, SER97A, SER97E, THR104A, THR104E, THR346A, THR346E, THR54A, THR54E, THR59A, THR59E, TYR149A, TYR149E, TYR18A, TYR18E, TYR56A, TYR56E, VAL106A, VAL106E, VAL141A, VAL141E, VAL142A, VAL142E, VAL91A, VAL91E
• B-C: ASN487B, ASP480B, GLU184C, GLY188C, GLY478B, HIS189C, ILE190C, LEU479B, LYS185C, LYS187C, LYS192C, PHE483B, SER186C
• B-G: ARG528B, ARG528G, ASN485B, ASN485G, ASN487B, ASN487G, GLU486B, GLU486G, GLU488B, GLU488G, GLU517B, GLU517G, GLU518B, GLU518G, GLU524B, GLU524G, GLY506B, GLY506G, HIS491B, HIS491G, HIS503B, HIS503G, ILE500B, ILE500G, ILE501B, ILE501G, ILE521B, ILE521G, LEU493B, LEU493G, LEU494B, LEU494G, LEU504B, LEU504G, LEU507B, LEU507G, LEU519G, LEU522B, LEU522G, LYS454B, LYS454G, LYS495B, LYS495G, LYS498B, LYS498G, LYS520B, LYS520G, LYS531B, LYS531G, MET502B, MET502G, PHE489B, PHE489G, PRO499B, PRO499G, SER515G, THR492B, THR492G, THR496B, THR496G, THR497B, THR497G, TRP525B, TRP525G, TYR490B, TYR490G, VAL451B
• B-H: ALA86H, ARG137B, ARG137H, ARG342H, ARG344B, ARG344H, ARG93B, ARG93H, ASN105B, ASN146B, ASN146H, ASN148B, ASN148H, ASP143B, ASP143H, ASP343B, ASP343H, ASP48H, GLN107B, GLN107H, GLN22B, GLN22H, GLN23B, GLN23H, GLN58B, GLN58H, GLN61B, GLN61H, GLN94B, GLN94H, GLU103B, GLU103H, GLU24B, GLU24H, GLU50B, GLU50H, GLU89B, GLU89H, GLY145B, GLY145H, GLY51B, GLY51H, HIS57B, HIS57H, ILE101B, ILE101H, ILE102B, ILE102H, ILE19B, ILE19H, ILE21B, ILE21H, ILE98B, ILE98H, LEU153B, LEU153H, LEU345B, LEU345H, LEU53B, LEU53H, LEU64B, LEU64H, LEU95B, LEU95H, LYS147B, LYS147H, LYS52B, LYS52H, MET144B, MET144H, MET96B, MET96H, MET99B, MET99H, PHE49B, PHE49H, PHE92B, PHE92H, PRO25B, PRO25H, PRO55B, PRO55H, PRO84B, PRO84H, SER100B, SER100H, SER140B, SER140H, SER20B, SER20H, SER60B, SER60H, SER90B, SER90H, SER97B, SER97H, THR104B, THR104H, THR346B, THR346H, THR54B, THR54H, THR59B, THR59H, TYR149B, TYR149H, TYR18B, TYR18H, TYR56B, TYR56H, VAL106B, VAL106H, VAL141B, VAL141H, VAL142B, VAL142H, VAL91B, VAL91H
• C-D: ALA348C, ALA86C, ARG137C, ARG137D, ARG342C, ARG342D, ARG344C, ARG344D, ARG93C, ARG93D, ASN146C, ASN146D, ASN148C, ASN148D, ASP143C, ASP143D, ASP343C, ASP343D, GLN107C, GLN107D, GLN22C, GLN22D, GLN23C, GLN23D, GLN58C, GLN58D, GLN61C, GLN61D, GLN94C, GLN94D, GLU103C, GLU103D, GLU24C, GLU24D, GLU50C, GLU50D, GLU89C, GLU89D, GLY145C, GLY145D, GLY51C, GLY51D, HIS57C, HIS57D, ILE101C, ILE101D, ILE102C, ILE102D, ILE19C, ILE19D, ILE21C, ILE21D, ILE98C, ILE98D, LEU153C, LEU153D, LEU345C, LEU345D, LEU53C, LEU53D, LEU64C, LEU64D, LEU95C, LEU95D, LYS147C, LYS147D, LYS347C, LYS52C, LYS52D, MET144C, MET144D, MET96C, MET96D, MET99C, MET99D, PHE49C, PHE49D, PHE92C, PHE92D, PRO25C, PRO25D, PRO55C, PRO55D, PRO84C, PRO84D, SER100C, SER100D, SER140C, SER140D, SER20C, SER20D, SER60C, SER60D, SER90C, SER90D, SER97C, SER97D, THR104C, THR104D, THR346D, THR54C, THR54D, THR59C, THR59D, TYR149C, TYR149D, TYR18C, TYR18D, TYR56C, TYR56D, VAL106C, VAL106D, VAL141C, VAL141D, VAL142C, VAL142D, VAL91C, VAL91D
• C-F: ASN69C, ASN69F, ASP76C, ASP76F, GLU110C, GLU110F, GLY113C, GLY113F, GLY65C, GLY65F, GLY70C, GLY70F, ILE67C, ILE67F, ILE71C, ILE71F, ILE72C, ILE72F, LEU111C, LEU111F, LEU64C, LEU64F, LEU66C, LEU66F, LYS109C, LYS37C, LYS37F, LYS75C, LYS75F, PRO34C, PRO34F, SER108C, SER68C, SER68F, THR112C, THR112F, THR114C, THR114F, VAL77C
• C-G: ALA387G, ARG159C, ARG513G, ASN146C, ASN148C, ASN156C, ASN510G, ASN514G, ASP143C, ASP154C, ASP329G, GLU357G, GLU385G, GLU508G, GLU509G, GLY113C, GLY145C, HIS189C, ILE328G, LEU153C, LEU155C, LEU507G, LYS109C, LYS147C, LYS150C, LYS152C, LYS384G, LYS75C, MET144C, MET1C, MET505G, MET512G, PHE333G, PRO115C, SER118C, SER157C, SER332G, SER383G, THR114C, THR151C, THR330G, TYR149C, TYR386G, VAL158C, VAL358G, VAL388G, VAL511G
• D-E: ARG528D, ARG528E, ASN485D, ASN487D, ASN487E, GLU486D, GLU486E, GLU488D, GLU488E, GLU517D, GLU517E, GLU518D, GLU518E, GLU524D, GLU524E, GLY506D, GLY506E, HIS491D, HIS491E, HIS503D, HIS503E, ILE500D, ILE500E, ILE501D, ILE501E, ILE521D, ILE521E, LEU493D, LEU493E, LEU494D, LEU494E, LEU504D, LEU504E, LEU507D, LEU507E, LEU519E, LEU522D, LEU522E, LYS454D, LYS454E, LYS495D, LYS495E, LYS498D, LYS498E, LYS520D, LYS520E, LYS531D, LYS531E, MET502D, MET502E, PHE489D, PHE489E, PRO499D, PRO499E, SER515D, SER515E, THR492D, THR492E, THR496D, THR496E, THR497D, THR497E, TRP525D, TRP525E, TYR490D, TYR490E, VAL451D, VAL451E
• D-F: ALA387D, ARG159F, ARG513D, ASN146F, ASN148F, ASN156F, ASN510D, ASN514D, ASP154F, ASP329D, GLU385D, GLU508D, GLU509D, GLY113F, GLY145F, GLY506D, GLY74F, HIS189F, ILE328D, LEU153F, LEU155F, LEU507D, LYS109F, LYS147F, LYS150F, LYS152F, LYS384D, LYS75F, MET1F, MET505D, MET512D, PHE333D, PRO115F, SER118F, SER157F, SER332D, SER383D, THR112F, THR114F, THR151F, THR330D, TYR149F, TYR386D, VAL158F, VAL358D, VAL388D, VAL511D
• D-G: ARG137D, ARG137G, ASN360D, ASN382D, ASN382G, ASN87D, ASN87G, ASP136G, ASP362D, ASP362G, ASP381D, ASP381G, GLU133D, GLU133G, GLU179D, GLU179G, GLU385D, GLU385G, ILE183G, ILE380G, LEU361D, LEU361G, LEU378D, LEU378G, LYS129D, LYS129G, LYS384D, SER186G, SER379D, SER379G, SER383D, SER383G, VAL91D, VAL91G
• E-F: ASN487E, ASP480E, GLU184F, GLU486E, GLU488E, GLY188F, GLY478E, HIS189F, ILE190F, LEU191F, LEU479E, LEU484E, LYS185F, LYS187F, LYS192F, PHE483E, SER186F
• F-G: ALA86F, ALA86G, ARG137F, ARG137G, ARG342G, ARG344F, ARG344G, ARG93F, ARG93G, ASN105G, ASN146F, ASN146G, ASN148F, ASN148G, ASP143F, ASP143G, ASP343F, ASP343G, GLN107F, GLN107G, GLN22F, GLN22G, GLN23F, GLN23G, GLN58F, GLN58G, GLN61F, GLN61G, GLN94F, GLN94G, GLU103F, GLU103G, GLU24F, GLU24G, GLU50F, GLU50G, GLU89F, GLU89G, GLY145F, GLY145G, GLY51F, GLY51G, HIS57F, HIS57G, ILE101F, ILE101G, ILE102F, ILE102G, ILE19F, ILE19G, ILE21F, ILE21G, ILE98F, ILE98G, LEU153F, LEU153G, LEU345F, LEU345G, LEU53F, LEU53G, LEU64F, LEU64G, LEU95F, LEU95G, LYS147F, LYS147G, LYS52F, LYS52G, MET144F, MET144G, MET96F, MET96G, MET99F, MET99G, PHE49F, PHE49G, PHE92F, PHE92G, PRO25F, PRO25G, PRO55F, PRO55G, PRO84F, PRO84G, SER100F, SER100G, SER140F, SER140G, SER20F, SER20G, SER60F, SER60G, SER90F, SER90G, SER97F, SER97G, THR104F, THR104G, THR346F, THR346G, THR54F, THR54G, THR59F, THR59G, TYR149F, TYR149G, TYR18F, TYR18G, TYR56F, TYR56G, VAL106F, VAL106G, VAL141F, VAL141G, VAL142F, VAL142G, VAL91F, VAL91G
• F-H: ARG528F, ARG528H, ASN485F, ASN485H, ASN487F, ASN487H, GLU486F, GLU486H, GLU488F, GLU488H, GLU517F, GLU517H, GLU518F, GLU518H, GLU524F, GLU524H, GLY506F, GLY506H, HIS491F, HIS491H, HIS503F, HIS503H, ILE500F, ILE500H, ILE501F, ILE501H, ILE521F, ILE521H, LEU493F, LEU493H, LEU494F, LEU494H, LEU504F, LEU504H, LEU507F, LEU507H, LEU519H, LEU522F, LEU522H, LYS454F, LYS454H, LYS495F, LYS495H, LYS498F, LYS498H, LYS520F, LYS520H, LYS531F, LYS531H, MET502F, MET502H, PHE489F, PHE489H, PRO499F, PRO499H, SER515H, THR492F, THR492H, THR496F, THR496H, THR497F, THR497H, TRP525F, TRP525H, TYR490F, TYR490H, VAL451F, VAL451H