3E1Z

crystal structure of the parasite protesase inhibitor chagasin in complex with papain

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 97
  • Norm. En. per Res.: -3.2734
• 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	-28.8352	0.6671	-289.35	-317.5181	97	8	5	10543	0	10	15

Interface residues

• A-B: ALA136B, ALA137B, ALA160B, ALA27B, ALA35A, ALA67A, ARG145B, ARG59B, ARG91A, ASN175B, ASN18B, ASN29A, ASN55A, ASN64B, ASP158B, ASP99A, CYS22B, CYS25B, CYS63B, GLN142B, GLN19B, GLU101A, GLU135B, GLU44A, GLU89B, GLY138B, GLY178B, GLY180B, GLY182B, GLY185B, GLY20B, GLY23B, GLY33A, GLY40A, GLY41A, GLY62B, GLY65B, GLY66A, GLY66B, GLY68A, GLY90B, HIS159B, HIS98A, LEU134B, LEU143B, LEU64A, LEU65A, LYS139B, LYS156B, LYS17B, LYS43A, LYS63A, MET90A, PHE141B, PHE207B, PHE34A, PRO30A, PRO59A, PRO60A, PRO68B, PRO92A, SER100A, SER131B, SER176B, SER205B, SER21B, SER24B, SER28A, SER29B, SER60B, SER62A, SER70B, SER97A, THR179B, THR204B, THR31A, THR32A, THR42A, THR94A, TRP177B, TRP181B, TRP26B, TRP69B, TRP93A, TYR116B, TYR144B, TYR37A, TYR57A, TYR61B, TYR67B, TYR88B, TYR89A, VAL132B, VAL133B, VAL157B, VAL161B, VAL16B