3BQU

crystal structure of the 2f5 fab'-3h6 fab complex

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: B-D
  • Int. Res.: 51
  • Norm. En. per Res.: -3.0141
• 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	-19.6866	11.8122	-470.325	-478.1994	185	27	13	18504	5	22	19
A-C	0.0	0.0	-0.0214	-0.0214	4	0	0	9	0	0	0
A-D	0.0	0.0	-0.8404	-0.8404	6	0	0	157	0	0	0
B-C	0.0	166.9806	-26.2919	140.6887	28	1	0	943	2	13	19
B-D	-22.2848	-1.3196	-130.116	-153.7204	51	5	0	4714	0	3	0
C-D	-21.3553	-20.3181	-510.384	-552.0575	185	20	7	19639	1	13	10

Interface residues

• A-B: ALA118B, ALA130A, ALA144B, ALA154B, ALA155B, ALA156B, ALA187B, ALA1A, ALA32A, ALA34A, ALA46B, ALA51A, ALA51B, ALA98B, ARG100B, ARG101B, ARG103A, ARG142A, ARG37A, ARG40B, ARG60B, ASN117B, ASN137A, ASN138A, ASP120B, ASP122A, ASP163B, ASP167A, ASP170A, ASP50A, ASP58B, CYS134A, CYS159B, CYS88A, CYS97B, GLN124A, GLN124B, GLN160A, GLN166A, GLN190B, GLN38A, GLN41B, GLN45A, GLN6A, GLN89A, GLN90A, GLU123A, GLU161A, GLU165A, GLU48B, GLU55A, GLU6B, GLY100A, GLY101A, GLY123B, GLY125B, GLY158B, GLY181B, GLY193B, GLY35B, GLY37B, GLY41A, GLY44B, GLY99A, HIS183B, HIS92A, HIS96A, HIS99B, ILE117A, ILE39B, ILE48A, ILE52B, ILE53B, LEU125A, LEU135A, LEU136A, LEU143B, LEU157B, LEU160B, LEU175A, LEU179A, LEU181A, LEU189B, LEU194B, LEU197B, LEU2A, LEU33A, LEU46A, LEU47A, LEU47B, LEU4B, LEU50B, LEU54A, LEU65B, LEU91A, LYS126A, LYS162B, LYS169A, LYS228B, LYS45B, LYS59B, MET119B, PHE116A, PHE118A, PHE139A, PHE141B, PHE185B, PHE93A, PHE96B, PHE98A, PRO119A, PRO120A, PRO142B, PRO145B, PRO186B, PRO40A, PRO43A, PRO44A, PRO63B, PRO95A, SER114A, SER121A, SER127A, SER131A, SER139B, SER159A, SER162A, SER168A, SER174A, SER176A, SER177A, SER180B, SER191B, SER192B, SER196B, SER198B, SER199B, SER205B, SER31A, SER42A, SER52A, SER53A, SER56A, SER62B, SER64B, THR129A, THR164A, THR172A, THR178A, THR180A, THR184B, THR202B, THR30A, THR85A, THR94B, THR97A, TRP122B, TRP35A, TRP38B, TRP49B, TYR173A, TYR195B, TYR36A, TYR49A, TYR54B, TYR61B, TYR86A, TYR87A, TYR94A, TYR95B, VAL115A, VAL116B, VAL121B, VAL132A, VAL133A, VAL140B, VAL163A, VAL182B, VAL188B, VAL200B, VAL201B, VAL203B, VAL226B, VAL230B, VAL29A
• A-C: ASP50C, PHE93A, THR53C, TYR94A
• A-D: ALA1A, GLY102D, ILE101D, PRO95A, TYR103D, TYR94A
• B-C: ARG60B, ASN93C, ASP28C, ASP30C, ASP31C, ASP32C, ASP50C, ASP56B, ASP57B, ASP58B, ASP92C, GLY108B, GLY33B, GLY51C, GLY68C, ILE29C, LEU94C, LYS59B, PHE32B, PRO103B, PRO110B, SER49C, SER55B, SER91C, THR53C, TYR54B, TYR67C, VAL109B
• B-D: ALA51B, ALA57D, ARG60B, ARG68B, ARG86B, ARG98D, ASN52D, ASN66B, ASP31D, ASP57B, ASP58B, CYS53D, GLY102D, GLY104D, GLY56D, ILE101D, ILE51D, ILE52B, ILE71B, LEU50B, LEU65B, LEU69B, LYS59B, MET34D, PHE29D, PHE33D, PRO107D, PRO108D, PRO63B, SER100D, SER105D, SER106D, SER28D, SER62B, SER64B, THR15B, THR17B, THR30D, THR55D, THR67B, THR70B, THR74D, THR85B, THR99D, TRP49B, TYR103D, TYR32D, TYR50D, TYR54D, TYR61B, VAL87B
• C-D: ALA130C, ALA134D, ALA179D, ALA97D, ARG199D, ARG224D, ARG45C, ARG55C, ARG98D, ASN103C, ASN137C, ASN138C, ASN161C, ASN34C, ASN59D, ASN93C, ASP165C, ASP167C, ASP170C, ASP32C, ASP46D, ASP50C, ASP85C, ASP92C, CYS134C, CYS151D, CYS88C, CYS96D, GLN114D, GLN124C, GLN182D, GLN38C, GLN39D, GLN62D, GLN6C, GLN6D, GLN90C, GLU123C, GLU1C, GLU42C, GLY100C, GLY101C, GLY104D, GLY113D, GLY115D, GLY128C, GLY129C, GLY136D, GLY150D, GLY155D, GLY158C, GLY173D, GLY41C, GLY42D, GLY49D, GLY51C, GLY99C, HIS175D, HIS35D, ILE101D, ILE117C, ILE221D, ILE48C, ILE48D, LEU125C, LEU133D, LEU136C, LEU149D, LEU152D, LEU160C, LEU179C, LEU181C, LEU181D, LEU185D, LEU188D, LEU45D, LEU46C, LEU47C, LEU4D, LEU89C, LEU94C, LYS154D, LYS169C, LYS207C, LYS219D, LYS220D, LYS38D, LYS39C, LYS43D, LYS63D, MET146D, MET175C, MET33C, PHE109D, PHE118C, PHE135C, PHE139C, PHE177D, PHE209C, PHE64D, PHE98C, PRO107D, PRO108D, PRO110D, PRO119C, PRO120C, PRO132D, PRO135D, PRO178D, PRO40C, PRO43C, PRO44C, PRO56C, PRO95C, SER100D, SER105D, SER106D, SER116C, SER121C, SER122C, SER127C, SER129D, SER131C, SER137D, SER162C, SER172D, SER174C, SER176C, SER177C, SER189D, SER190D, SER191D, SER208C, SER44D, SER49C, SER61D, SER91C, THR102C, THR114C, THR126C, THR148D, THR164C, THR172C, THR176D, THR178C, THR180C, THR187D, THR193D, THR53C, THR97C, THR99D, TRP112D, TRP163C, TRP165D, TRP35C, TRP36D, TRP47D, TYR103D, TYR111D, TYR131D, TYR173C, TYR186C, TYR186D, TYR32D, TYR36C, TYR50D, TYR60D, TYR86C, TYR87C, TYR95D, TYR96C, VAL115C, VAL130D, VAL132C, VAL133C, VAL147D, VAL153D, VAL159C, VAL174D, VAL180D, VAL192D, VAL222D, VAL2D, VAL37D, VAL93D