1T1F

crystal structure of native antithrombin in its monomeric form

• Total interactions analyzed: 3
• Total true interactions: 2
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 51
  • Norm. En. per Res.: -3.2748
• Hub Node: A(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
A-C	-54.5846	-31.2321	-72.4082	-158.2249	51	25	1	4483	1	17	15
B-C	-58.3283	-32.2539	-76.431	-167.0131	51	19	1	4228	1	18	15

Interface residues

• A-C: ALA179C, ALA184C, ALA185C, ALA206C, ALA387A, ALA391A, ARG183C, ARG235A, ARG393A, ASN178C, ASN187C, ASN208C, ASN233A, ASN396A, ASN398A, ASP200C, GLN181C, GLU177C, GLU180C, GLU205C, GLU209C, GLU232A, GLU237A, GLY196C, GLY392A, HIS319A, ILE186C, ILE202C, ILE207C, ILE390A, LEU210C, LEU395A, LYS176C, LYS188C, LYS236A, PHE175C, PRO203C, PRO231A, PRO397A, SER182C, SER191C, SER204C, SER230A, SER394A, THR199C, THR234A, TRP189C, TYR253A, VAL201C, VAL388A, VAL389A
• B-C: ALA179B, ALA184B, ALA185B, ALA206B, ALA387C, ALA391C, ARG183B, ARG235C, ARG393C, ASN178B, ASN187B, ASN208B, ASN233C, ASN396C, ASN398C, ASP200B, GLN181B, GLU177B, GLU180B, GLU205B, GLU209B, GLU232C, GLU237C, GLY196B, GLY392C, HIS319C, ILE186B, ILE202B, ILE207B, ILE390C, LEU210B, LEU395C, LYS176B, LYS188B, LYS236C, PHE175B, PRO203B, PRO231C, PRO397C, SER182B, SER191B, SER204B, SER230C, SER394C, THR199B, THR234C, TRP189B, TYR253C, VAL201B, VAL388C, VAL389C