3K24

crystal structure of mature apo-cathepsin l c25a mutant in complex with gln-leu-ala peptide

• Total interactions analyzed: 6
• Total true interactions: 3
• Strongest Interaction:
  • Chains: B-C
  • Int. Res.: 39
  • Norm. En. per Res.: -3.0252
• Hub Node: A(2)

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	-4.5321	-77.9454	-79.2708	-161.7484	71	1	0	3965	10	33	39
A-D	-21.7607	0.0	-94.7511	-116.5118	39	4	4	3391	0	0	0
B-C	-27.6856	0.0	-90.2976	-117.9832	39	3	4	3399	0	0	0

Interface residues

• A-B: ARG44A, ARG44B, ARG8A, ARG8B, ASN18A, ASP6A, ASP6B, GLU148A, GLU148B, GLU191A, GLU191B, GLU192A, GLU192B, GLU86A, GLU86B, GLU87A, GLU87B, GLU9A, GLU9B, GLY11A, GLY11B, GLY149A, GLY149B, GLY194A, GLY194B, GLY196A, GLY196B, GLY197A, GLY197B, GLY43A, GLY43B, ILE46A, ILE46B, LEU184A, LEU184B, LEU45A, LEU45B, LYS10A, LYS10B, LYS147A, LYS147B, LYS17A, LYS17B, LYS200A, LYS200B, MET195A, MET195B, PHE39A, PHE39B, PRO15A, PRO15B, SER47A, SER47B, THR14A, THR14B, THR42A, THR42B, TRP193A, TRP193B, TRP7A, TRP7B, TYR12A, TYR12B, TYR182A, TYR182B, TYR198A, TYR198B, VAL13A, VAL13B, VAL16A, VAL16B
• A-D: ALA111D, ALA135A, ALA138A, ALA214A, ALA25A, ALA27A, ASN62A, ASN66A, ASP137A, ASP160A, ASP162A, ASP71A, CYS22A, CYS65A, GLN109D, GLN19A, GLU63A, GLY164A, GLY23A, GLY61A, GLY64A, GLY67A, GLY68A, HIS163A, ILE136A, LEU110D, LEU69A, MET161A, MET70A, PHE28A, SER133A, SER188A, SER24A, SER29A, TRP189A, TRP26A, TYR72A, VAL134A, VAL165A
• B-C: ALA111C, ALA135B, ALA138B, ALA214B, ALA25B, ALA27B, ASN62B, ASN66B, ASP137B, ASP160B, ASP162B, ASP71B, CYS22B, CYS65B, GLN109C, GLN19B, GLU63B, GLY164B, GLY23B, GLY61B, GLY64B, GLY67B, GLY68B, HIS163B, ILE136B, LEU110C, LEU69B, MET161B, MET70B, PHE28B, SER133B, SER188B, SER24B, SER29B, TRP189B, TRP26B, TYR72B, VAL134B, VAL165B