3QB2

the crystal structure of immunity factor for spn (ifs)

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: A-B
  • Int. Res.: 156
  • Norm. En. per Res.: -3.3568
• Hub Node: A(3)

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	-43.8928	-79.0982	-400.663	-523.654	156	9	10	15466	6	53	41
A-C	0.0	0.0	-5.0374	-5.0374	22	0	0	442	0	8	3
A-D	0.0	-1.9637	-11.9229	-13.8866	19	0	0	620	0	18	20
C-D	-32.9384	-34.445	-279.771	-347.1544	133	8	9	10860	2	44	31

Interface residues

• A-B: ALA120A, ALA125A, ALA134A, ALA136A, ALA61A, ALA61B, ALA98A, ALA98B, ARG115A, ARG132A, ARG156A, ARG156B, ARG163B, ARG39A, ARG39B, ARG40A, ARG40B, ASN100A, ASN100B, ASN104A, ASN104B, ASN121A, ASN97A, ASN97B, ASP128A, ASP148B, ASP152A, ASP152B, ASP41A, ASP41B, GLN116A, GLN12A, GLN12B, GLN147A, GLN147B, GLN168B, GLN16A, GLN16B, GLN94A, GLU107A, GLU107B, GLU133A, GLU142A, GLU142B, GLU155B, GLU159B, GLU167B, GLU173B, GLU51A, GLU51B, GLU55A, GLU55B, GLU9A, GLU9B, GLY45B, GLY57A, GLY57B, GLY7A, GLY7B, HIS10A, HIS10B, HIS137A, HIS145B, ILE118A, ILE122A, ILE131A, ILE158B, ILE171B, ILE63A, ILE63B, ILE89A, LEU102A, LEU102B, LEU103A, LEU103B, LEU109A, LEU109B, LEU119A, LEU126A, LEU140A, LEU151A, LEU151B, LEU166B, LEU170B, LEU54A, LEU54B, LEU8A, LEU8B, LEU96A, LYS124A, LYS127A, LYS139A, LYS139B, LYS169B, LYS3A, LYS3B, LYS64A, LYS64B, LYS6A, LYS6B, PHE111A, PHE111B, PHE143A, PHE143B, PHE161B, PHE162B, PHE165B, PHE62A, PHE62B, PRO110A, PRO110B, PRO5A, PRO5B, PRO60A, PRO60B, SER108A, SER108B, SER117A, SER164B, SER172B, SER42A, SER42B, THR123A, THR149A, THR149B, THR157B, THR160B, THR38A, THR38B, TYR105A, TYR105B, TYR106A, TYR106B, TYR112A, TYR11A, TYR11B, TYR138A, TYR146A, TYR146B, TYR2A, TYR2B, TYR56A, TYR56B, TYR59A, TYR59B, TYR90A, VAL154A, VAL154B, VAL4A, VAL4B, VAL52A, VAL52B, VAL58A, VAL58B, VAL93A, VAL93B
• A-C: ALA125A, ALA129A, ASN121A, ASN82A, ASP128A, GLU107C, GLU79A, GLY65C, GLY84A, HIS130A, ILE131A, ILE63C, LEU109C, LEU78A, LYS124A, LYS127A, LYS64C, PHE62C, PRO110C, SER108C, SER83A, TYR106C
• A-D: ALA86A, ASN82A, ASP128A, ASP32A, ASP88A, GLN85A, GLY84A, HIS10D, HIS130A, ILE131A, ILE89A, LYS13D, LYS26A, LYS33D, LYS3D, SER31A, SER83A, TYR2D, VAL4D
• C-D: ALA136C, ALA61C, ALA61D, ALA98C, ARG115D, ARG132D, ARG156C, ARG156D, ARG163C, ARG39C, ARG39D, ARG40C, ARG40D, ASN100C, ASN100D, ASN104C, ASN104D, ASN97C, ASN97D, ASP148C, ASP148D, ASP152C, ASP152D, ASP41C, ASP41D, ASP49C, GLN12C, GLN12D, GLN147C, GLN147D, GLN16D, GLN94C, GLN94D, GLU107C, GLU107D, GLU142C, GLU142D, GLU155C, GLU155D, GLU159D, GLU51C, GLU51D, GLU55C, GLU55D, GLU9C, GLU9D, GLY57C, GLY57D, GLY7C, GLY7D, HIS10C, HIS10D, HIS145C, ILE122D, ILE158C, ILE63C, ILE63D, LEU102C, LEU102D, LEU103C, LEU103D, LEU109C, LEU109D, LEU119D, LEU126D, LEU140C, LEU140D, LEU151C, LEU151D, LEU54C, LEU54D, LEU8C, LEU8D, LEU96D, LYS139C, LYS139D, LYS3C, LYS3D, LYS64C, LYS64D, LYS6C, LYS6D, PHE111C, PHE111D, PHE143C, PHE143D, PHE161C, PHE62C, PHE62D, PRO110C, PRO110D, PRO5C, PRO5D, PRO60C, PRO60D, SER108C, SER108D, SER164C, SER42D, THR123D, THR149C, THR149D, THR157C, THR157D, THR160C, THR38D, TYR105C, TYR105D, TYR106C, TYR106D, TYR112C, TYR112D, TYR11C, TYR11D, TYR146C, TYR146D, TYR2C, TYR2D, TYR56C, TYR56D, TYR59C, TYR59D, TYR90C, VAL154C, VAL154D, VAL4C, VAL4D, VAL52C, VAL52D, VAL58C, VAL58D, VAL93C, VAL93D