3DIE

domain swapping of staphylococcus aureus thioredoxin w28a mutant

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 206
  • Norm. En. per Res.: -8.4275
• 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	-509.3757	-43.5701	-1183.12	-1736.0658	206	57	68	43724	3	51	48

Interface residues

• A-B: ALA26A, ALA26B, ALA28A, ALA28B, ALA2A, ALA2B, ALA36A, ALA36B, ALA43A, ALA43B, ALA44A, ALA44B, ALA50A, ALA50B, ALA64A, ALA64B, ALA65A, ALA65B, ALA97A, ALA97B, ALA9A, ALA9B, ASN60A, ASN60B, ASN95A, ASP101A, ASP101B, ASP10A, ASP10B, ASP12A, ASP12B, ASP23A, ASP23B, ASP45A, ASP45B, ASP51A, ASP51B, ASP56A, ASP56B, ASP58A, ASP58B, ASP80A, ASP80B, ASP85A, ASP85B, ASP8A, ASP8B, CYS29A, CYS29B, CYS32A, CYS32B, GLN20A, GLN20B, GLN82A, GLN82B, GLN91A, GLN91B, GLU16A, GLU16B, GLU40A, GLU40B, GLU41A, GLU41B, GLU47A, GLU47B, GLU59A, GLU59B, GLU68A, GLU68B, GLY18A, GLY18B, GLY30A, GLY30B, GLY48A, GLY48B, GLY81A, GLY81B, GLY89A, GLY89B, HIS0A, HIS0B, HIS103A, HIS103B, ILE35A, ILE35B, ILE3A, ILE3B, ILE52A, ILE52B, ILE72A, ILE72B, ILE76A, ILE76B, LEU100A, LEU100B, LEU104A, LEU104B, LEU21A, LEU21B, LEU39A, LEU39B, LEU42A, LEU42B, LEU53A, LEU53B, LEU55A, LEU55B, LEU75A, LEU75B, LEU96A, LEU96B, LYS102A, LYS102B, LYS14A, LYS14B, LYS33A, LYS33B, LYS49A, LYS49B, LYS54A, LYS54B, LYS5A, LYS5B, LYS66A, LYS66B, LYS79A, LYS79B, LYS86A, LYS86B, LYS93A, LYS93B, MET1A, MET1B, MET34A, MET34B, MET70A, MET70B, PHE11A, PHE11B, PHE24A, PHE24B, PHE78A, PHE78B, PHE90A, PHE90B, PRO31A, PRO31B, PRO37A, PRO37B, PRO61A, PRO61B, PRO73A, PRO73B, PRO83A, PRO83B, PRO92A, PRO92B, SER-1A, SER-1B, SER13B, SER17A, SER17B, SER62A, SER62B, SER71A, SER71B, THR27A, THR27B, THR63A, THR63B, THR74A, THR74B, THR7A, THR7B, TRP25A, TRP25B, TYR46A, TYR46B, TYR67A, TYR67B, VAL15A, VAL15B, VAL19A, VAL19B, VAL22A, VAL22B, VAL38A, VAL38B, VAL4A, VAL4B, VAL57A, VAL57B, VAL69A, VAL69B, VAL6A, VAL6B, VAL77A, VAL77B, VAL84A, VAL84B, VAL87A, VAL87B, VAL88A, VAL88B, VAL99A, VAL99B