2P3F

crystal structure of the factor xa/nap5 complex

• Total interactions analyzed: 3
• Total true interactions: 2
• Strongest Interaction:
  • Chains: H-N
  • Int. Res.: 106
  • Norm. En. per Res.: -4.8494
• Hub Node: H(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
H-L	-42.956	-32.6793	619.731	544.0956	82	33	2	10063	2	17	17
H-N	-74.9025	-97.7108	-341.422	-514.0354	106	31	1	11984	7	38	37

Interface residues

• H-L: ALA112L, ALA119H, ALA121H, ALA123L, ALA128H, ARG113L, ARG115H, ARG125H, ARG202H, ARG71H, ASN117H, ASN93L, ASP126H, ASP205H, ASP239H, ASP24H, ASP92L, ASP95L, ASP97L, CYS100L, CYS109L, CYS111L, CYS122H, CYS124L, CYS132L, CYS22H, CYS27H, CYS89L, CYS96L, GLN133H, GLN135L, GLN98L, GLU124H, GLU138L, GLU26H, GLU49H, GLY114L, GLY133L, GLY25H, GLY94L, HIS101L, ILE137H, ILE46H, LEU123H, LEU131H, LEU137L, LEU235H, LEU47H, LYS122L, LYS134L, LYS204H, LYS23H, MET116H, MET157H, MET242H, PHE114H, PHE203H, PHE208H, PHE50H, PHE99L, PRO120H, PRO124H, PRO129L, PRO131L, PRO28H, SER110L, SER130H, SER48H, SER90L, THR113H, THR131H, THR136L, THR206H, TRP127H, TRP29H, TYR115L, TYR130L, TYR207H, TYR51H, VAL118H, VAL200H, VAL209H
• H-N: ALA183H, ALA190H, ALA221H, ALA47N, ALA55H, ALA61H, ARG143H, ARG150H, ARG222H, ARG38N, ARG40N, ASN35H, ASP102H, ASP13N, ASP14N, ASP189H, ASP194H, ASP34N, ASP52N, CYS15N, CYS191H, CYS21N, CYS220H, CYS37N, CYS42H, CYS42N, CYS50N, CYS58H, CYS6N, GLN151H, GLN18N, GLN192H, GLN61H, GLU10N, GLU146H, GLU188H, GLU217H, GLU31N, GLU32N, GLU33N, GLU37H, GLU39H, GLU5N, GLU97H, GLY142H, GLY149H, GLY16N, GLY184H, GLY193H, GLY196H, GLY197H, GLY216H, GLY218H, GLY226H, GLY40H, GLY41N, GLY43H, GLY53N, HIS145H, HIS57H, ILE16H, ILE175H, ILE176H, ILE212H, ILE227H, ILE36N, LEU12N, LEU33H, LEU43N, LEU44N, LEU59H, LYS147H, LYS224H, LYS51N, LYS62H, LYS96H, MET180H, PHE141H, PHE174H, PHE41H, PHE94H, PRO35N, PRO45N, PRO46N, PRO4N, SER152H, SER172H, SER173H, SER195H, SER214H, SER39N, THR144H, THR17N, THR95H, THR98H, TRP11N, TRP215H, TYR225H, TYR228H, TYR3N, TYR60H, TYR99H, VAL138H, VAL17H, VAL213H, VAL49N