1XKA

factor xa complexed with a synthetic inhibitor fx-2212a, (2s)-(3'-amidino-3-biphenylyl)-5-(4-pyridylamino)pentanoic acid

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: L-C
  • Int. Res.: 88
  • Norm. En. per Res.: 4.0999
• Hub Node: L(1)

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
L-C	-48.6762	-32.6783	442.143	360.7885	88	24	3	10991	1	20	23

Interface residues

• L-C: ALA112L, ALA119C, ALA121C, ALA123L, ALA128C, ARG113L, ARG115C, ARG125C, ARG139L, ARG202C, ARG71C, ASN117C, ASN93L, ASP126C, ASP205C, ASP239C, ASP24C, ASP92L, ASP95L, ASP97L, CYS100L, CYS111L, CYS122C, CYS124L, CYS132L, CYS22C, CYS27C, CYS89L, CYS96L, GLN133C, GLN135L, GLN98L, GLU124C, GLU138L, GLU26C, GLU49C, GLY114L, GLY128L, GLY133L, GLY25C, GLY78C, GLY79C, GLY94L, HIS101L, ILE137C, ILE238C, ILE46C, LEU123C, LEU131C, LEU137L, LEU235C, LEU47C, LYS122L, LYS134L, LYS204C, LYS23C, LYS243C, MET116C, MET157C, MET242C, PHE114C, PHE203C, PHE208C, PHE50C, PHE99L, PRO120C, PRO124C, PRO126L, PRO129L, PRO131L, PRO28C, SER110L, SER130C, SER48C, SER90L, THR113C, THR131C, THR136L, THR206C, TRP127C, TRP29C, TYR115L, TYR130L, TYR207C, TYR51C, VAL118C, VAL200C, VAL209C