3S24

crystal structure of human mrna guanylyltransferase

• Total interactions analyzed: 21
• Total true interactions: 12
• Strongest Interaction:
  • Chains: C-F
  • Int. Res.: 111
  • Norm. En. per Res.: -2.5967
• Hub Node: A(4)

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	0.0	-13.1349	-38.4417	-51.5766	40	0	0	2148	1	18	21
A-D	-12.9653	-18.1494	-147.131	-178.2457	109	15	1	7730	2	26	31
A-E	-26.9303	-32.7751	-182.455	-242.1604	113	18	1	7943	4	21	31
A-G	0.0	-2.0028	-21.1409	-23.1437	33	1	0	1102	0	12	10
B-C	-7.9204	-11.5106	-129.892	-149.323	85	12	1	6338	0	18	22
B-D	0.0	0.0	-0.381	-0.381	2	0	0	59	0	2	1
B-G	0.0	0.0	-0.0006	-0.0006	2	0	0	2	0	1	2
B-F	-5.3957	-5.2566	-13.5157	-24.168	35	1	0	833	1	9	11
C-F	-37.5721	-51.9348	-198.723	-288.2299	111	14	2	8797	3	30	28
D-E	0.0	-7.6269	-25.9053	-33.5322	35	2	0	1315	1	10	9
E-G	-21.551	-14.6362	-184.074	-220.2612	111	15	1	7942	2	21	28
G-F	-9.6844	-41.4911	-87.4602	-138.6357	69	5	1	4509	3	29	38

Interface residues

• A-B: ARG334B, ARG411A, ARG422A, ASP402B, ASP417A, CYS419A, GLN405B, GLU385A, GLU394B, GLU426A, GLY399B, HIS393A, HIS393B, HIS435A, ILE389A, ILE401B, LEU333B, LEU400B, LEU424A, LYS239B, LYS290A, LYS395B, LYS397A, LYS397B, LYS413A, LYS423A, MET396B, MET437A, PHE415A, PHE416A, PRO391B, PRO414A, SER292A, SER390B, SER421A, THR398B, THR404B, THR420A, TRP293A, VAL291A
• A-D: ALA499D, ALA542D, ALA544D, ARG380A, ARG422A, ARG452D, ARG475D, ARG496D, ARG564A, ASN280A, ASN280D, ASN378A, ASN485D, ASN521D, ASN522D, ASN540D, ASN547D, ASN551D, ASP277D, ASP285A, ASP374A, ASP376A, ASP417A, ASP454A, ASP454D, ASP455A, ASP563A, CYS261A, CYS375A, CYS419A, CYS453A, CYS546D, GLN259A, GLN279A, GLN279D, GLN484D, GLN500D, GLU264A, GLU479D, GLU520D, GLU560A, GLY262A, GLY373A, GLY446A, GLY477D, GLY478D, GLY480D, GLY487D, ILE281D, ILE418A, ILE501D, ILE549D, ILE562A, LEU283A, LEU283D, LEU284A, LEU286A, LEU457D, LEU481D, LEU482D, LEU488D, LEU489D, LYS278D, LYS282A, LYS282D, LYS287A, LYS290A, LYS447A, LYS449A, LYS502D, MET276D, MET476D, MET543D, MET557D, PHE377A, PHE415A, PHE416A, PHE469D, PHE498D, PHE519D, PHE561A, PHE561D, PRO288A, PRO371A, PRO444A, PRO450A, PRO483D, PRO497D, SER275D, SER523D, SER548D, SER550D, THR420A, THR445A, THR474D, TRP263A, TRP524D, TYR289A, TYR448A, TYR490D, TYR494D, TYR539D, VAL274D, VAL291A, VAL379A, VAL486D, VAL491D, VAL503D, VAL525D
• A-E: ALA499A, ALA542A, ALA544A, ALA567E, ARG380E, ARG422E, ARG452E, ARG475A, ARG496A, ARG564E, ASN280A, ASN280E, ASN378E, ASN485A, ASN521A, ASN522A, ASN540A, ASN547A, ASN551A, ASP277A, ASP277E, ASP285E, ASP374E, ASP376E, ASP417E, ASP454A, ASP454E, ASP455E, ASP563E, CYS261E, CYS375E, CYS419E, CYS453E, CYS546A, CYS565E, GLN259E, GLN279A, GLN279E, GLN484A, GLN500A, GLU264E, GLU479A, GLU520A, GLU560E, GLY262E, GLY373E, GLY446E, GLY451E, GLY477A, GLY478A, GLY480A, HIS258E, ILE281A, ILE281E, ILE418E, ILE456E, ILE501A, ILE549A, ILE562E, LEU283A, LEU283E, LEU284E, LEU286E, LEU457E, LEU482A, LEU488A, LEU489A, LYS278A, LYS278E, LYS282A, LYS282E, LYS287E, LYS290E, LYS366E, LYS447E, LYS449E, LYS502A, MET276A, MET476A, MET543A, MET557A, PHE260E, PHE377E, PHE416E, PHE469A, PHE498A, PHE519A, PHE561E, PRO288E, PRO371E, PRO444E, PRO450E, PRO497A, PRO552A, SER275A, SER523A, SER548A, SER550A, THR445E, THR474A, THR566E, TRP263E, TRP524A, TYR289E, TYR448E, TYR494A, TYR539A, VAL274A, VAL379E, VAL486A, VAL491A, VAL525A, VAL545A
• A-G: ASN339G, ASN368G, ASN521A, ASN522A, ASP374G, CYS261G, GLN247G, GLN255G, GLN259G, GLU264G, GLU506A, GLU520A, GLY262G, GLY265G, HIS258G, LEU507A, LYS256G, LYS366G, LYS447G, LYS502A, LYS505A, LYS518A, PHE260G, PHE526A, PRO371G, SER369G, SER463A, SER523A, THR504A, TRP263G, TRP524A, VAL503A, VAL525A
• B-C: ALA499C, ALA542C, ALA544C, ARG380B, ARG452B, ARG496C, ARG564B, ASN280B, ASN280C, ASN378B, ASN521C, ASN522C, ASN540C, ASN547C, ASN551C, ASP277B, ASP277C, ASP285B, ASP374B, ASP376B, ASP417B, ASP454B, ASP454C, ASP455B, CYS261B, CYS375B, CYS419B, CYS453B, CYS546C, GLN279B, GLN279C, GLN500C, GLU264B, GLU520C, GLY262B, GLY373B, GLY446B, GLY451B, GLY487C, ILE281B, ILE418B, ILE473C, ILE501C, ILE549C, ILE562B, LEU283B, LEU284B, LEU286B, LEU457B, LEU488C, LEU489C, LYS278B, LYS278C, LYS282B, LYS282C, LYS287B, LYS290B, LYS447B, LYS449B, LYS502C, MET543C, PHE260B, PHE377B, PHE469C, PHE498C, PHE519C, PHE561B, PRO288B, PRO444B, PRO450B, PRO497C, PRO552C, SER523C, SER548C, SER550C, THR445B, TRP263B, TRP524C, TYR289B, TYR448B, TYR494C, TYR539C, VAL491C, VAL503C, VAL545C
• B-D: ARG496D, LYS397B
• B-G: ARG334B, ARG334G
• B-F: ASN339B, ASN368B, ASN521F, ASN522F, ASP374B, CYS257B, CYS261B, GLN255B, GLN259B, GLU264B, GLU520F, GLU556F, GLY262B, HIS258B, ILE365B, ILE501F, LEU507F, LYS256B, LYS331B, LYS366B, LYS447B, LYS502F, LYS555F, PHE260B, PHE329B, PHE519F, PHE526F, PRO371B, PRO450B, SER369B, SER463F, SER523F, TRP263B, TRP524F, VAL525F
• C-F: ALA499F, ALA542F, ALA544F, ARG380C, ARG452C, ARG452F, ARG475F, ARG496F, ARG564C, ARG564F, ASN280C, ASN280F, ASN378C, ASN485F, ASN521F, ASN522F, ASN540F, ASN547F, ASN551F, ASP277C, ASP277F, ASP285C, ASP285F, ASP374C, ASP376C, ASP417C, ASP454C, ASP454F, ASP455C, ASP563C, CYS261C, CYS375C, CYS419C, CYS453C, CYS546F, GLN279C, GLN279F, GLN484F, GLN500F, GLU264C, GLU520F, GLU560C, GLY262C, GLY265C, GLY373C, GLY446C, GLY451C, GLY480F, GLY487F, ILE281C, ILE281F, ILE418C, ILE501F, ILE549F, ILE562C, LEU283C, LEU283F, LEU284C, LEU286C, LEU286F, LEU457C, LEU457F, LEU482F, LEU488F, LEU489F, LYS278C, LYS278F, LYS282C, LYS282F, LYS287C, LYS290C, LYS447C, LYS449C, LYS502F, MET276F, MET476F, MET543F, PHE377C, PHE416C, PHE469F, PHE498F, PHE519F, PHE561C, PHE561F, PRO288C, PRO371C, PRO444C, PRO450C, PRO483F, PRO497F, PRO552F, SER275F, SER523F, SER548F, SER550F, THR445C, THR474F, TRP263C, TRP524F, TYR289C, TYR448C, TYR494F, TYR539F, VAL274F, VAL372C, VAL379C, VAL486F, VAL491F, VAL503F, VAL525F, VAL545F
• D-E: ARG330E, ASN339E, ASN368E, ASN521D, ASN522D, ASP374E, CYS261E, GLN255E, GLN259E, GLN370E, GLU264E, GLU520D, GLU556D, GLY262E, HIS258E, LEU481D, LYS256E, LYS331E, LYS366E, LYS447E, LYS502D, LYS518D, LYS555D, MET335E, PHE260E, PHE329E, PHE367E, PHE519D, PHE559D, PRO371E, SER369E, SER463D, SER523D, THR554D, VAL372E
• E-G: ALA499E, ALA542E, ALA544E, ARG380G, ARG422G, ARG452G, ARG475E, ARG496E, ARG564E, ARG564G, ASN280E, ASN280G, ASN378G, ASN485E, ASN521E, ASN522E, ASN540E, ASN547E, ASN551E, ASP277E, ASP277G, ASP285G, ASP374G, ASP376G, ASP417G, ASP454E, ASP454G, ASP455G, ASP563G, CYS261G, CYS375G, CYS419G, CYS453G, CYS546E, CYS565G, GLN259G, GLN279E, GLN279G, GLN484E, GLN500E, GLU264G, GLU479E, GLU520E, GLU560G, GLY262G, GLY373G, GLY446G, GLY477E, GLY478E, GLY480E, GLY487E, HIS258G, ILE281G, ILE418G, ILE456G, ILE501E, ILE549E, ILE562G, LEU283G, LEU284G, LEU286G, LEU457G, LEU488E, LEU489E, LYS278E, LYS278G, LYS282E, LYS282G, LYS287G, LYS290G, LYS366G, LYS447G, LYS449G, LYS502E, LYS518E, MET276E, MET476E, MET543E, MET557E, PHE260G, PHE377G, PHE469E, PHE498E, PHE519E, PHE559G, PHE561E, PHE561G, PRO288G, PRO371G, PRO444G, PRO450G, PRO497E, PRO552E, SER275E, SER523E, SER548E, SER550E, THR445G, THR474E, THR566G, TRP263G, TRP524E, TYR289G, TYR448G, TYR494E, TYR539E, VAL379G, VAL486E, VAL491E, VAL503E, VAL545E
• G-F: ALA355G, ALA430F, ARG330G, ARG334G, ARG350G, ARG358F, ARG358G, ARG411F, ASN352G, ASP332G, ASP349G, ASP402G, ASP417F, CYS419F, GLN354G, GLN405G, GLU394F, GLU394G, GLU432F, GLU436F, GLY353G, GLY399F, GLY399G, HIS393F, HIS393G, ILE348G, ILE401G, ILE418F, LEU333F, LEU333G, LEU381F, LEU400G, LEU424F, LYS290F, LYS331G, LYS395G, LYS397F, LYS397G, LYS403F, LYS403G, LYS413F, LYS423F, LYS431F, MET335G, MET396F, MET396G, MET437F, PHE329G, PHE415F, PHE416F, PRO357G, PRO391G, PRO414F, SER292F, SER390G, SER409F, SER421F, SER434F, THR398F, THR398G, THR404G, THR420F, TRP293F, VAL236G, VAL238G, VAL291F, VAL351F, VAL356G, VAL433F