3D1D

hexagonal crystal structure of tas3 c-terminal alpha motif

• Total interactions analyzed: 15
• Total true interactions: 8
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 75
  • Norm. En. per Res.: -2.5389
• 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	-22.4009	-20.9579	-147.06	-190.4188	75	11	6	7416	1	11	9
A-C	0.0	-3.8712	-5.472	-9.3432	25	2	0	493	0	5	7
A-D	0.0	1.5554	-19.7051	-18.1497	17	0	0	951	0	8	3
B-C	-9.3244	-15.8532	-131.21	-156.3876	62	10	8	6228	1	12	9
B-D	0.0	19.886	-85.9189	-66.0329	48	2	2	4162	0	13	12
C-D	0.0	-16.3033	-137.953	-154.2563	72	8	6	7049	1	11	7
C-F	0.0	-5.1807	-66.9396	-72.1203	43	6	0	2938	0	8	9
E-F	0.0	-15.6175	-129.404	-145.0215	64	8	7	6145	1	11	8

Interface residues

• A-B: ALA458A, ALA483A, ALA514B, ASN468A, ASN492B, ASN504B, ASN527A, ASN527B, ASP472A, CYS455A, GLN475A, GLN478A, GLN490B, GLN493B, GLN498B, GLN508B, GLU457A, GLU491B, GLU497B, GLU506B, GLY516B, GLY525A, GLY525B, HIS465A, HIS467A, ILE463A, ILE471A, ILE519B, LEU459A, LEU470A, LEU479A, LEU495B, LEU499B, LEU502B, LEU505B, LEU522A, LEU522B, LEU528A, LEU530B, LYS461A, LYS469A, LYS507B, LYS513B, LYS521A, LYS521B, LYS526A, LYS526B, MET500B, PHE473A, PHE481A, PHE487A, PHE501B, PRO464A, PRO494B, PRO496B, SER454A, SER474A, SER482A, SER484A, SER503B, SER517A, SER517B, SER518A, SER518B, THR524A, THR524B, TYR466A, TYR520A, TYR520B, VAL460A, VAL462A, VAL476A, VAL480A, VAL523A, VAL523B
• A-C: ALA514A, ASN436A, ASN527C, ASP472A, GLN490C, GLU485C, GLU491C, GLU506A, GLU544A, GLY525C, ILE489C, LEU438A, LYS469A, LYS513A, LYS526C, PHE487C, PHE511A, PRO488C, PRO510A, SER474A, SER482C, SER484C, SER517A, THR509A, TYR439A
• A-D: ASN436A, ASN468A, ASN492D, ASP472A, ASP531D, GLN490D, GLN493D, GLU491D, GLU497D, HIS467A, ILE489D, LEU470A, LEU530D, LYS469A, PRO494D, PRO496D, SER529D
• B-C: ALA458B, ALA483B, ALA514C, ASN468B, ASN492C, ASN504C, ASN527C, ASP472B, CYS455B, GLN475B, GLN478B, GLN478C, GLN493C, GLN498C, GLN508C, GLU457B, GLU491C, GLU506C, GLY516C, GLY525B, GLY525C, HIS465B, ILE463B, ILE471B, ILE519C, LEU459B, LEU470B, LEU479B, LEU495C, LEU499C, LEU502C, LEU505C, LEU522C, LYS461B, LYS469B, LYS507C, LYS513C, LYS521B, LYS521C, LYS526B, LYS526C, MET500C, PHE473B, PHE501C, PRO464B, PRO494C, PRO496C, SER454B, SER474B, SER482B, SER484B, SER503C, SER517C, SER518C, THR524C, TYR466B, TYR520C, VAL460B, VAL462B, VAL476B, VAL480B, VAL523C
• B-D: ALA483D, ALA512B, ALA514B, ASN436B, ASN441B, ASN452D, ASN492D, ASN527D, ASP437B, ASP472B, GLN475B, GLN478B, GLN490D, GLN508B, GLU485D, GLU491D, GLU506B, GLU544B, GLY525D, ILE440B, ILE471B, ILE489D, LEU438B, LEU477B, LEU528D, LEU543B, LYS469B, LYS486D, LYS513B, LYS521B, LYS526D, PHE473B, PHE487D, PHE511B, PHE532D, PRO488D, PRO510B, SER454D, SER474B, SER482D, SER484D, SER529D, THR509B, THR524D, TRP442B, TYR439B, TYR466B, VAL515B
• C-D: ALA458C, ALA483C, ALA514D, ASN468C, ASN492D, ASN504D, ASN527D, ASP472C, CYS455C, GLN475C, GLN478C, GLN490D, GLN493D, GLN498D, GLN508D, GLU457C, GLU491D, GLU497D, GLU506D, GLY516D, GLY525C, GLY525D, HIS465C, ILE463C, ILE471C, ILE519D, LEU459C, LEU470C, LEU479C, LEU495D, LEU499D, LEU502D, LEU505D, LEU522C, LEU522D, LEU528D, LEU530D, LYS461C, LYS469C, LYS507D, LYS513D, LYS521C, LYS521D, LYS526C, LYS526D, MET500D, PHE473C, PHE481C, PHE487C, PHE501D, PRO464C, PRO494D, PRO496D, SER454C, SER474C, SER482C, SER484C, SER503D, SER517C, SER517D, SER518C, SER518D, THR524C, THR524D, TYR466C, TYR520C, TYR520D, VAL460C, VAL462C, VAL476C, VAL480C, VAL523D
• C-F: ALA456C, ALA458C, ASN441C, ASN452C, ASN504F, CYS455C, GLN450C, GLN508F, GLU457C, GLU497F, GLU506F, GLU539C, GLU544F, ILE440C, ILE542F, LEU443C, LEU446C, LEU459C, LEU499F, LEU502F, LEU505F, LEU537F, LEU543C, LYS444C, LYS461C, LYS486C, LYS507F, LYS538F, MET500F, PHE448C, PHE449C, PHE501F, PRO496F, SER445C, SER447C, SER453C, SER454C, SER503F, SER541F, THR451C, THR509F, TRP442C, VAL460C
• E-F: ALA458F, ALA483F, ALA514E, ASN468F, ASN492E, ASN504E, ASN527E, ASP472F, CYS455F, GLN475F, GLN478E, GLN478F, GLN493E, GLN498E, GLN508E, GLU457F, GLU506E, GLY516E, GLY525E, GLY525F, HIS465F, ILE463F, ILE471F, ILE519E, LEU459F, LEU470F, LEU479F, LEU495E, LEU499E, LEU502E, LEU505E, LEU522E, LEU522F, LEU530E, LYS461F, LYS469F, LYS507E, LYS513E, LYS521E, LYS521F, LYS526E, LYS526F, MET500E, PHE473F, PHE481F, PHE501E, PRO464F, PRO494E, PRO496E, SER454F, SER474F, SER482F, SER484F, SER503E, SER517E, SER518E, THR524E, TYR466F, TYR520E, VAL460F, VAL462F, VAL476F, VAL480F, VAL523E