1NQ9

crystal structure of antithrombin in the pentasaccharide-bound intermediate state

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: I-L
  • Int. Res.: 97
  • Norm. En. per Res.: -4.1168
• Hub Node: I(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
I-L	-95.2084	-48.1086	-256.013	-399.33	97	16	12	9786	4	24	27

Interface residues

• I-L: ALA242L, ALA249L, ALA384I, ALA387I, ALA391I, ALA404L, ALA427L, ARG235I, ARG235L, ARG259L, ARG261L, ARG262L, ARG393I, ARG399I, ARG406L, ASN233I, ASN233L, ASN396I, ASN398I, ASN405L, ASN428L, CYS247L, GLN254I, GLN254L, GLN268L, GLU232I, GLU237L, GLU255I, GLU255L, GLU271L, GLU289L, GLU313I, GLU378I, GLY244L, GLY256I, GLY256L, GLY266L, GLY392I, HIS319L, ILE284L, ILE390I, LEU224I, LEU238L, LEU270L, LEU272L, LEU283L, LEU285L, LEU316L, LEU395I, LEU409L, LYS226I, LYS228I, LYS236L, LYS241L, LYS257I, LYS257L, LYS275I, LYS287L, MET251L, MET252L, MET314L, MET315I, MET315L, MET320L, PHE229I, PHE229L, PHE239L, PHE258L, PHE323L, PHE408L, PRO231I, PRO286L, PRO288L, PRO321L, PRO397I, PRO407L, PRO429L, SER227I, SER230I, SER246L, SER250L, SER385I, SER394I, THR386I, TRP225I, TYR240L, TYR253I, TYR253L, TYR260L, VAL263L, VAL269L, VAL317L, VAL318L, VAL388I, VAL389I, VAL410L, VAL426L