1RQL

crystal structure of phosponoacetaldehyde hydrolase complexed with magnesium and the inhibitor vinyl sulfonate

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 67
  • Norm. En. per Res.: -2.9389
• 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	0.0	0.0	-196.907	-196.907	67	2	3	7321	0	4	6

Interface residues

• A-B: ALA158A, ALA158B, ALA170A, ALA170B, ALA197A, ALA197B, ARG195A, ARG195B, ASN169A, ASN169B, ASN179A, ASN179B, ASN196A, ASN196B, ASP155A, ASP155B, CYS166A, CYS166B, GLU172A, GLU172B, GLU193A, GLU193B, GLY174A, GLY174B, GLY194A, GLY194B, GLY198A, GLY198B, LEU173A, LEU173B, LYS121A, LYS168A, LYS168B, LYS192A, LYS192B, MET165A, MET165B, MET171A, MET171B, MET178A, MET178B, MET181A, MET181B, MET199A, MET199B, PRO157A, PRO157B, PRO161A, PRO161B, PRO163A, PRO163B, PRO177A, PRO177B, TRP164A, TRP164B, TYR162A, TYR162B, TYR167A, TYR167B, TYR176A, TYR176B, VAL151A, VAL151B, VAL156A, VAL156B, VAL175A, VAL175B