1TS3

h135a mutant of toxic shock syndrome toxin-1 from s. aureus

• Total interactions analyzed: 3
• Total true interactions: 2
• Strongest Interaction:
  • Chains: A-C
  • Int. Res.: 123
  • Norm. En. per Res.: -4.0714
• 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	-10.0231	-3.6002	-29.2142	-42.8375	37	2	0	1801	0	22	29
A-C	-71.8648	-131.697	-297.221	-500.7828	123	16	1	10216	12	47	47

Interface residues

• A-B: ASN222B, ASN22A, ASN290B, ASN90A, ASP120A, ASP320B, GLU224B, GLU24A, GLU260B, GLU292B, GLU60A, GLU92A, GLY259B, GLY59A, LEU294B, LEU94A, LYS122A, LYS258B, LYS261B, LYS293B, LYS322B, LYS58A, LYS61A, LYS93A, PHE256B, PHE56A, PRO295B, PRO95A, THR221B, THR238B, THR257B, THR291B, THR38A, THR57A, THR91A, VAL225B, VAL25A
• A-C: ARG145A, ARG468C, ARG545C, ARG68A, ASN37A, ASN3A, ASN403C, ASN405C, ASN437C, ASN465C, ASN5A, ASP11A, ASP18A, ASP39A, ASP404C, ASP408C, ASP411C, ASP418C, ASP439C, ASP4A, ASP8A, GLN139A, GLN473C, GLN484C, GLN539C, GLN73A, GLN84A, GLU132A, GLU499C, GLU99A, GLY16A, GLY40A, GLY416C, GLY440C, GLY478C, GLY78A, HIS474C, HIS482C, HIS74A, HIS82A, ILE140A, ILE406C, ILE42A, ILE442C, ILE481C, ILE540C, ILE6A, ILE81A, LEU10A, LEU409C, LEU410C, LEU464C, LEU64A, LEU9A, LYS114A, LYS118A, LYS36A, LYS407C, LYS436C, LYS467C, LYS470C, LYS471C, LYS514C, LYS518C, LYS571C, LYS67A, LYS70A, LYS71A, LYS7A, PHE119A, PHE20A, PHE420C, PHE483C, PHE519C, PHE83A, PRO117A, PRO497C, PRO517C, PRO97A, SER146A, SER147A, SER14A, SER15A, SER17A, SER1A, SER401C, SER414C, SER415C, SER417C, SER41A, SER441C, SER472C, SER546C, SER547C, SER72A, THR138A, THR19A, THR21A, THR2A, THR38A, THR402C, THR419C, THR421C, THR438C, THR469C, THR475C, THR479C, THR538C, THR69A, THR75A, THR79A, TRP116A, TRP12A, TRP412C, TRP516C, TYR115A, TYR13A, TYR144A, TYR413C, TYR480C, TYR515C, TYR544C, TYR80A