3LIQ

crystal structure of htlv protease complexed with the inhibitor, kni- 10673

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 123
  • Norm. En. per Res.: -6.8318
• 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-B	-216.1162	-15.1298	-609.07	-840.316	123	26	23	22820	3	14	13

Interface residues

• A-B: ALA105A, ALA105B, ALA35A, ALA35B, ALA59A, ALA59B, ALA8A, ALA8B, ARG103A, ARG103B, ARG10A, ARG10B, ARG81A, ARG81B, ARG9A, ARG9B, ASN96A, ASN96B, ASP104A, ASP104B, ASP32A, ASP32B, ASP36A, ASP36B, ASP65B, ASP6A, ASP6B, ASP93B, CYS109A, CYS109B, GLN107A, GLN107B, GLN108A, GLN108B, GLN110A, GLN110B, GLN62A, GLN62B, GLN64A, GLN64B, GLY102A, GLY102B, GLY111A, GLY111B, GLY34A, GLY34B, GLY58A, GLY58B, GLY60A, GLY60B, GLY61A, GLY61B, HIS66A, HIS66B, ILE100A, ILE100B, ILE101A, ILE101B, ILE13A, ILE13B, ILE3A, ILE3B, ILE85A, ILE85B, LEU106A, LEU106B, LEU113A, LEU113B, LEU115A, LEU115B, LEU30A, LEU30B, LEU31A, LEU31B, LEU57A, LEU57B, LEU5A, LEU5B, LEU78A, LEU78B, LEU87A, LEU87B, LEU91A, LEU91B, LYS95B, MET37A, MET37B, PHE67A, PHE67B, PHE80A, PHE80B, PRO116A, PRO116B, PRO11A, PRO11B, PRO1A, PRO1B, PRO4A, PRO4B, PRO79A, PRO79B, PRO7A, PRO7B, THR33A, THR33B, THR38A, THR38B, THR63A, THR63B, TRP98A, TRP98B, TYR114A, TYR114B, VAL112A, VAL112B, VAL12A, VAL12B, VAL2A, VAL2B, VAL39A, VAL39B, VAL56A, VAL56B