3K2U

crystal structure of hgfa in complex with the allosteric inhibitory antibody fab40

• Total interactions analyzed: 6
• Total true interactions: 4
• Strongest Interaction:
  • Chains: A-H
  • Int. Res.: 69
  • Norm. En. per Res.: -3.8655
• 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	-25.7972	10.7859	653.496	638.4847	36	11	0	3340	0	3	7
A-H	-30.5062	-5.7677	-230.447	-266.7209	69	12	4	8015	2	3	4
A-L	-11.4803	6.0168	-65.5897	-71.0532	42	9	2	3477	0	6	7
H-L	-58.606	-17.3113	305.618	229.7007	179	17	13	16380	2	17	10

Interface residues

• A-B: ALA139A, ALA200A, ALA207A, ALA392B, ARG114A, ARG395B, ARG396B, ASN204A, CYS122A, CYS393B, GLN116A, GLN119A, GLN137A, GLU157A, GLU202A, GLY205A, GLY25A, GLY394B, HIS27A, HIS48A, ILE121A, LEU123A, LEU159A, LEU209A, LEU23A, LEU46A, LYS203A, PHE117A, PRO120A, PRO28A, SER115A, SER26A, TRP29A, TYR208A, VAL206A, VAL47A
• A-H: ALA100H, ALA53H, ALA56A, ALA56H, ALA60H, ALA71H, ALA97H, ARG107A, ARG241A, ARG243A, ARG61A, ASN30H, ASN98A, ASP100A, ASP101H, ASP240A, ASP61H, ASP62A, GLU86A, GLY31H, GLY49H, GLY50H, GLY54H, GLY55H, GLY65H, HIS101A, HIS35H, HIS57A, HIS60A, ILE106A, ILE29H, ILE51H, ILE85A, ILE89A, LEU103A, LEU105A, LEU93A, LYS64H, LYS87A, PHE100H, PHE59A, PHE97A, PRO52H, PRO60A, PRO90A, PRO99A, PRO99H, SER60A, SER95A, THR32H, THR57H, THR73H, THR92A, TRP237A, TRP47H, TRP51A, TRP95H, TRP96H, TRP98H, TYR33H, TYR52H, TYR58H, TYR59H, TYR88A, TYR91A, TYR94A, VAL104A, VAL64A, VAL96A
• A-L: ALA174A, ALA232A, ALA32L, ALA94L, ALA96L, ARG230A, ARG93L, ASN179A, ASN233A, ASN92L, ASN98A, ASP100A, ASP236A, ASP28L, GLN89L, GLN90L, GLY127A, GLY68L, HIS101A, ILE176A, ILE2L, LEU93A, MET180A, PHE53L, PHE97A, PRO178A, PRO95L, SER177A, SER30L, SER50L, SER91L, SER95A, THR31L, THR92A, THR97L, TRP237A, TYR234A, TYR49L, TYR91A, TYR94A, VAL235A, VAL29L
• H-L: ALA100H, ALA125H, ALA130L, ALA136H, ALA137H, ALA168H, ALA32L, ALA34L, ALA40H, ALA43L, ALA51L, ALA60H, ALA93H, ALA94L, ALA96L, ALA97H, ARG142L, ARG38H, ARG93L, ASN137L, ASN138L, ASN158L, ASN92L, ASP101H, ASP122L, ASP144H, ASP167L, ASP1L, ASP61H, CYS134L, CYS140H, CYS214L, CYS216H, CYS88L, CYS92H, GLN100L, GLN105H, GLN124L, GLN160L, GLN166L, GLN171H, GLN37L, GLN38L, GLN39H, GLN6L, GLN89L, GLN90L, GLU123L, GLU161L, GLU165L, GLU213L, GLU46H, GLU6H, GLY101L, GLY104H, GLY106H, GLY139H, GLY157L, GLY162H, GLY174H, GLY212L, GLY41L, GLY42H, GLY44H, GLY49H, GLY99L, HIS164H, HIS35H, ILE117L, ILE48L, LEU124H, LEU125L, LEU135L, LEU136L, LEU138H, LEU141H, LEU170H, LEU175H, LEU175L, LEU178H, LEU179L, LEU181L, LEU45H, LEU46L, LEU47L, LYS103L, LYS143H, LYS207L, LYS209H, LYS210H, LYS214H, LYS39L, LYS42L, LYS43H, LYS45L, LYS64H, LYS94H, PHE100H, PHE116L, PHE118L, PHE122H, PHE139L, PHE166H, PHE209L, PHE53L, PHE98L, PRO119L, PRO120L, PRO123H, PRO126H, PRO167H, PRO40L, PRO44L, PRO95L, PRO99H, SER114L, SER120H, SER121L, SER127H, SER131L, SER159L, SER162L, SER172H, SER173H, SER174L, SER176L, SER177H, SER177L, SER179H, SER180H, SER215H, SER50L, SER56L, SER62H, SER91L, THR129L, THR135H, THR164L, THR165H, THR172L, THR178L, THR180L, THR183H, THR31L, THR85L, THR97L, TRP103H, TRP35L, TRP36H, TRP47H, TRP95H, TRP98H, TYR102H, TYR173L, TYR176H, TYR36L, TYR49L, TYR55L, TYR58H, TYR59H, TYR86L, TYR87L, TYR91H, VAL121H, VAL132L, VAL133L, VAL142H, VAL163H, VAL163L, VAL169H, VAL181H, VAL182H, VAL207H, VAL211H, VAL2H, VAL33L, VAL37H, VAL48H, VAL89H