1S4E

pyrococcus furiosus galactokinase in complex with galactose, adp and magnesium

• Total interactions analyzed: 36
• Total true interactions: 7
• Strongest Interaction:
  • Chains: H-I
  • Int. Res.: 60
  • Norm. En. per Res.: -2.9304
• 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	0.0	0.0	-5.7198	-5.7198	11	2	0	314	0	1	0
A-C	-5.3209	-9.2618	-105.113	-119.6957	63	4	1	4961	0	26	30
A-F	0.0	22.333	-97.3831	-75.0501	45	4	6	4333	0	34	36
C-E	-2.6919	-14.827	-69.122	-86.641	51	1	0	3398	2	48	40
F-H	-3.2384	0.2379	-77.9412	-80.9417	55	0	0	3722	2	49	42
F-I	0.0	-4.9865	-0.8663	-5.8528	10	0	0	164	0	8	9
H-I	-24.7557	-42.6454	-108.423	-175.8241	60	16	1	5489	5	28	34

Interface residues

• A-B: ASN119A, ASN123A, ASN123B, ASN125A, ASN125B, GLN120A, ILE126B, LEU121A, LEU124A, LEU124B, TYR122A
• A-C: ALA132C, ALA201A, ARG203A, ARG205A, ARG212A, ARG235A, ARG279A, ASN125C, ASN277A, ASP127C, ASP167C, ASP226A, GLN169C, GLN172C, GLN82C, GLU199A, GLU202A, GLU209A, GLU217C, GLU221C, GLU276A, GLU83C, GLY215A, GLY215C, GLY228A, GLY84C, HIS234A, ILE126C, ILE149C, ILE206A, ILE213A, LEU129C, LEU133C, LEU134C, LEU166C, LEU171C, LEU211A, LEU214A, LEU230A, LEU233A, LYS130C, LYS131C, LYS136C, LYS137C, LYS216C, LYS220C, LYS225A, LYS229A, LYS236A, PHE153C, PHE157C, PHE237A, PRO128C, PRO231A, PRO232A, SER198A, SER210A, SER218C, THR168C, THR170C, TYR173C, TYR23C, TYR85C
• A-F: ALA292A, ALA292F, ALA297A, ALA297F, ALA320A, ALA320F, ALA326A, ALA326F, ARG329A, ARG329F, ASP316A, ASP316F, ASP318A, ASP318F, ASP325A, ASP325F, GLU294A, GLU294F, GLU330A, GLU330F, GLY296A, GLY296F, GLY324A, GLY324F, ILE323A, ILE323F, ILE327A, ILE327F, LEU295A, LEU295F, LYS290A, LYS290F, LYS291A, LYS291F, LYS317A, LYS319A, LYS319F, LYS321A, LYS321F, PHE287A, PHE287F, THR322A, THR322F, VAL315A, VAL315F
• C-E: ALA201C, ALA246E, ALA270E, ALA275E, ARG203C, ARG205C, ARG212C, ARG235C, ARG243E, ARG247E, ARG279C, ARG279E, ASN277E, ASP273E, ASP286E, GLU199C, GLU202C, GLU209C, GLU224E, GLU250E, GLU276E, GLU294E, GLY144C, HIS234C, HIS271E, ILE206C, ILE213C, ILE266E, LEU195C, LEU230C, LEU233C, LEU267E, LEU274E, LYS236C, LYS236E, LYS265E, LYS290E, LYS291E, PHE237C, PRO146C, PRO231C, PRO232C, SER198C, SER210C, SER239E, THR268E, THR269E, TRP272E, TYR240E, TYR278E, VAL289E
• F-H: ALA201F, ALA246H, ALA270H, ALA275H, ARG203F, ARG205F, ARG212F, ARG235F, ARG243H, ARG247H, ARG279F, ARG279H, ASN277H, ASP273H, ASP286H, GLU194F, GLU199F, GLU202F, GLU209F, GLU224H, GLU250H, GLU261H, GLU276F, GLU276H, GLU294H, GLY228F, HIS234F, HIS271H, ILE206F, ILE213F, ILE266H, LEU195F, LEU230F, LEU233F, LEU267H, LEU274H, LYS236F, LYS236H, LYS262H, LYS265H, LYS290H, LYS291H, PHE237F, PHE287H, PRO231F, PRO232F, SER198F, SER210F, SER239H, THR268H, THR269H, TRP272H, TYR240H, TYR278H, VAL289H
• F-I: ARG212F, ARG212I, ASP61F, ASP61I, GLU217F, GLU217I, GLY215F, GLY215I, ILE213F, ILE213I
• H-I: ARG203H, ARG205H, ARG212H, ARG235H, ARG279H, ASN277H, ASP127I, ASP167I, ASP226H, GLN169I, GLN172I, GLN82I, GLU199H, GLU202H, GLU209H, GLU217I, GLU221I, GLU276H, GLU83I, GLY215H, GLY215I, GLY228H, GLY84I, HIS234H, ILE126I, ILE149I, ILE206H, ILE213H, ILE81I, LEU129I, LEU133I, LEU134I, LEU166I, LEU171I, LEU214H, LEU230H, LEU233H, LYS130I, LYS131I, LYS136I, LYS137I, LYS216I, LYS220I, LYS225H, LYS229H, LYS236H, PHE153I, PHE157I, PHE237H, PRO128I, PRO231H, PRO232H, SER210H, SER218I, THR168I, THR170I, TYR173I, TYR23I, TYR85I, VAL79I