3BTW

the crystal structures of the complexes between bovine beta- trypsin and ten p1 variants of bpti

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: E-I
  • Int. Res.: 87
  • Norm. En. per Res.: -3.9445
• Hub Node: E(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
E-I	-71.4577	5.6542	-277.366	-343.1695	87	9	3	9542	0	3	12

Interface residues

• E-I: ALA183E, ALA221E, ALA516I, ALA540I, ALA55E, ALA56E, ARG517I, ARG520I, ARG539I, ASN100E, ASN143E, ASN34E, ASN74E, ASN95E, ASN97E, ASP102E, ASP189E, ASP194E, CYS191E, CYS220E, CYS42E, CYS514I, CYS538I, CYS58E, GLN175E, GLN192E, GLN221E, GLY142E, GLY174E, GLY184E, GLY193E, GLY196E, GLY197E, GLY216E, GLY219E, GLY226E, GLY38E, GLY43E, GLY512I, GLY536I, GLY537I, HIS40E, HIS57E, ILE138E, ILE212E, ILE518I, ILE519I, ILE73E, LEU33E, LEU99E, LYS224E, LYS546I, LYS60E, MET180E, PHE41E, PHE533I, PRO152E, PRO225E, PRO513I, SER150E, SER190E, SER195E, SER214E, SER217E, SER32E, SER37E, SER61E, SER96E, THR149E, THR511I, THR98E, TRP141E, TRP215E, TRP515I, TYR151E, TYR172E, TYR228E, TYR39E, TYR510I, TYR535I, TYR59E, TYR94E, VAL17E, VAL199E, VAL213E, VAL227E, VAL534I