3JUW

putative gnat-family acetyltransferase from bordetella pertussis.

• Total interactions analyzed: 3
• Total true interactions: 3
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 73
  • Norm. En. per Res.: -5.042
• 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	-42.9187	-61.9535	-263.195	-368.0672	73	7	3	8351	12	34	28
A-C	-14.7654	-23.7916	-41.0486	-79.6055	33	2	1	1819	2	18	17
B-C	-3.0261	10.4681	-35.7033	-28.2613	32	1	0	1653	0	30	26

Interface residues

• A-B: ALA21A, ALA21B, ALA46A, ALA46B, ALA52A, ALA52B, ALA59A, ALA59B, ALA61A, ALA61B, ARG49A, ARG49B, ARG53A, ARG53B, ARG5A, ARG5B, ARG84A, ARG84B, ARG85A, ARG85B, ARG86A, ARG86B, ASN94A, ASN94B, ASP24A, ASP24B, ASP44A, ASP44B, ASP58A, ASP58B, ASP93A, ASP93B, CYS51A, CYS51B, GLN18A, GLN18B, GLN45A, GLN45B, GLN54A, GLN54B, GLN82A, GLN82B, GLU43A, GLU43B, GLY55A, GLY55B, GLY87A, GLY87B, GLY89A, GLY89B, LEU48A, LEU48B, LEU50A, LEU50B, PHE160A, PHE160B, PHE23A, PHE23B, PHE27A, PHE27B, PHE83A, PHE83B, PHE88A, SER19A, SER19B, THR42A, THR42B, TRP47A, TRP47B, TRP57A, TRP57B, TYR60A, TYR60B
• A-C: ALA103C, ALA105C, ALA159A, ALA163A, ALA164A, ARG109C, ARG138A, ARG31C, ARG33C, ARG39C, ARG86A, ASN140C, ASP157A, ASP161A, ASP34C, GLN107C, GLN32C, GLU35C, GLY108C, GLY162A, GLY87A, GLY89A, HIS106C, HIS165A, LEU167A, PHE160A, PHE88A, PRO142C, PRO90A, SER104C, SER156A, VAL102C, VAL158A
• B-C: ALA36B, ALA36C, ALA46C, ARG31B, ARG31C, ARG33B, ARG33C, ARG39B, ARG39C, ASP34B, ASP34C, ASP40B, ASP40C, ASP44B, ASP44C, GLN32B, GLN45B, GLN45C, GLU35B, GLU35C, GLU43B, GLU43C, GLY37B, GLY37C, HIS38B, HIS38C, LEU41B, LEU41C, PHE27B, PHE27C, THR42B, THR42C