3AYU

crystal structure of mmp-2 active site mutant in complex with app- drived decapeptide inhibitor

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 68
  • Norm. En. per Res.: -5.3336
• 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	-61.1649	-52.3741	-249.147	-362.686	68	7	8	8279	4	6	9

Interface residues

• A-B: ALA118A, ALA119A, ALA121A, ALA125A, ALA136A, ALA139A, ALA7B, ALA83A, ALA85A, ALA87A, ARG6A, ASN5B, ASP6B, ASP71A, ASP76A, ASP79A, ASP95A, GLU102A, GLU129A, GLY127A, GLY4B, GLY72A, GLY80A, GLY89A, GLY91A, GLY93A, GLY94A, HIS120A, HIS124A, HIS130A, HIS69A, HIS84A, HIS97A, ILE141A, ILE1B, LEU116A, LEU128A, LEU137A, LEU81A, LEU82A, LEU8B, LYS78A, MET138A, MET9B, PHE4A, PHE75A, PHE86A, PHE98A, PRO10B, PRO140A, PRO5A, PRO74A, PRO88A, PRO8A, SER113A, SER2B, SER96A, THR143A, THR90A, TRP104A, TRP10A, TYR112A, TYR142A, TYR144A, TYR3B, TYR73A, VAL117A, VAL92A