3RA7

bispecific digoxigenin binding antibodies for targeted payload delivery

• Total interactions analyzed: 6
• Total true interactions: 6
• Strongest Interaction:
  • Chains: L-H
  • Int. Res.: 191
  • Norm. En. per Res.: -2.7813
• Hub Node: L(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
L-H	-34.0261	-25.8976	-471.309	-531.2327	191	14	15	18606	2	11	11
L-M	0.0	0.0	-26.0401	-26.0401	34	2	0	1398	0	7	6
L-I	0.0	0.0	-8.941	-8.941	17	0	0	513	0	0	3
H-M	-15.0093	0.0	-24.0553	-39.0646	21	2	0	1098	0	1	5
H-I	-28.8899	64.7881	-162.848	-126.9498	69	11	0	5797	0	20	28
M-I	-28.7107	-14.6424	-481.829	-525.1821	195	13	13	19091	1	11	10

Interface residues

• L-H: ALA108H, ALA113H, ALA130L, ALA137H, ALA141H, ALA142H, ALA180H, ALA97H, ARG200H, ARG211L, ARG225H, ARG38H, ARG44H, ARG98H, ASN137L, ASN138L, ASN157L, ASN161L, ASN210L, ASN31L, ASN34L, ASN43H, ASP106H, ASP165L, ASP167L, ASP170L, ASP1L, ASP62H, CYS134L, CYS152H, CYS88L, CYS96H, GLN124L, GLN166L, GLN183H, GLN37L, GLN38L, GLN39H, GLN89L, GLN90L, GLU104H, GLU123L, GLU42H, GLU46H, GLU6H, GLY100H, GLY100L, GLY101L, GLY116H, GLY118H, GLY129L, GLY139H, GLY151H, GLY158L, GLY174H, GLY41L, GLY42L, GLY99L, HIS176H, ILE117L, ILE222H, ILE37H, ILE48L, ILE92L, LEU125L, LEU136H, LEU136L, LEU150H, LEU153H, LEU160L, LEU179L, LEU181L, LEU182H, LEU189H, LEU33L, LEU45H, LEU46L, LEU47L, LEU4H, LEU55L, LEU94L, LYS103L, LYS107H, LYS155H, LYS169L, LYS207L, LYS220H, LYS221H, LYS30L, LYS45L, MET112H, MET147H, MET175L, MET93H, PHE118L, PHE135L, PHE139L, PHE178H, PHE209L, PHE87L, PHE98L, PRO117H, PRO119L, PRO120L, PRO135H, PRO138H, PRO179H, PRO40L, PRO61H, PRO95L, PRO96L, PRO99H, SER101H, SER111H, SER116L, SER121L, SER122L, SER127L, SER131L, SER132H, SER140H, SER146H, SER162L, SER168L, SER172H, SER173H, SER174L, SER176L, SER177L, SER184H, SER190H, SER191H, SER192H, SER208L, SER35H, SER50H, SER51L, SER52L, SER56L, SER63H, SER91L, THR114L, THR126L, THR144H, THR149H, THR164L, THR172L, THR177H, THR178L, THR180L, THR188H, THR194H, THR43L, THR53L, THR85L, THR93L, THR97L, TRP115H, TRP163L, TRP166H, TRP35L, TRP36H, TRP47H, TYR105H, TYR109H, TYR110H, TYR114H, TYR134H, TYR173L, TYR32L, TYR36L, TYR49L, TYR50L, TYR57H, TYR59H, TYR60H, TYR86L, TYR95H, VAL115L, VAL132L, VAL133H, VAL133L, VAL148H, VAL154H, VAL159L, VAL175H, VAL181H, VAL193H, VAL223H, VAL44L, VAL48H
• L-M: ALA25M, ARG155L, ARG24L, ARG24M, ASN157L, ASN157M, ASN161L, ASP28L, ASP28M, ASP70L, ASP70M, GLN156L, GLN156M, GLN27L, GLN27M, GLU154L, GLY158L, GLY158M, GLY68L, GLY68M, ILE29L, ILE29M, LEU160L, LYS30L, LYS30M, PHE71M, SER26L, SER26M, SER67L, SER67M, THR69L, THR69M, VAL159L, VAL159M
• L-I: ASP185I, ASP1L, ASP28L, GLN183I, GLN27L, GLN3L, LEU182I, LEU186I, LEU94L, PRO95L, SER124I, SER184I, SER26L, SER88I, THR93L, VAL181I, VAL2L
• H-M: ALA126H, ALA25M, ASP185H, ASP1M, ASP28M, GLN183H, GLN27M, GLN3M, LEU182H, LEU186H, LEU94M, PRO95M, SER124H, SER125H, SER184H, SER26M, SER88H, THR69M, THR93M, VAL181H, VAL2M
• H-I: ALA126H, ALA126I, ARG38H, ARG38I, ARG44H, ARG67H, ARG67I, ASP185H, ASP185I, ASP62H, ASP62I, ASP90H, ASP90I, GLU42I, GLU46H, GLU46I, GLU89H, GLU89I, GLY15H, GLY15I, GLY16H, GLY16I, GLY66H, GLY66I, GLY87H, GLY87I, LEU11H, LEU11I, LEU86H, LEU86I, LYS13H, LYS13I, LYS65H, LYS65I, PHE158H, PHE158I, PHE68H, PHE68I, PRO14H, PRO14I, PRO61H, PRO61I, SER124H, SER124I, SER125H, SER125I, SER63H, SER63I, SER84H, SER84I, SER85H, SER85I, SER88H, SER88I, THR122H, THR122I, THR40I, THR91H, THR91I, TYR59H, TYR59I, TYR60H, TYR60I, VAL123H, VAL123I, VAL12H, VAL12I, VAL64H, VAL64I
• M-I: ALA108I, ALA113I, ALA130M, ALA137I, ALA141I, ALA142I, ALA180I, ALA49I, ALA58I, ALA97I, ARG200I, ARG211M, ARG225I, ARG38I, ARG44I, ARG98I, ASN137M, ASN138M, ASN145I, ASN157M, ASN161M, ASN210M, ASN31M, ASN34M, ASN43I, ASP106I, ASP165M, ASP167M, ASP170M, ASP1M, ASP62I, CYS134M, CYS152I, CYS88M, CYS96I, GLN124M, GLN143I, GLN183I, GLN38M, GLN39I, GLN3M, GLN6M, GLN89M, GLN90M, GLU104I, GLU123M, GLU42I, GLU46I, GLU6I, GLY100I, GLY100M, GLY101M, GLY116I, GLY118I, GLY129M, GLY139I, GLY151I, GLY156I, GLY158M, GLY174I, GLY41M, GLY42M, GLY99M, HIS176I, ILE117M, ILE222I, ILE37I, ILE48M, ILE92M, LEU125M, LEU136I, LEU136M, LEU150I, LEU153I, LEU160M, LEU179M, LEU181M, LEU182I, LEU186I, LEU189I, LEU33M, LEU45I, LEU46M, LEU47M, LEU4I, LEU55M, LEU94M, LYS103M, LYS107I, LYS155I, LYS169M, LYS207M, LYS220I, LYS45M, MET112I, MET147I, MET175M, MET4M, MET93I, PHE118M, PHE135M, PHE139M, PHE178I, PHE209M, PHE87M, PHE98M, PRO117I, PRO119M, PRO120M, PRO135I, PRO138I, PRO179I, PRO40M, PRO61I, PRO95M, PRO96M, PRO99I, SER101I, SER111I, SER116M, SER121M, SER122M, SER127M, SER131M, SER132I, SER140I, SER162M, SER172I, SER173I, SER174M, SER176M, SER177M, SER190I, SER191I, SER192I, SER208M, SER35I, SER50I, SER51M, SER52M, SER56M, SER63I, SER91M, SER9M, THR114M, THR126M, THR149I, THR164M, THR172M, THR177I, THR178M, THR180M, THR188I, THR194I, THR43M, THR53M, THR5M, THR85M, THR93M, THR97M, TRP115I, TRP163M, TRP166I, TRP35M, TRP36I, TRP47I, TYR105I, TYR109I, TYR110I, TYR114I, TYR134I, TYR173M, TYR187I, TYR32M, TYR36M, TYR49M, TYR50M, TYR57I, TYR59I, TYR60I, TYR86M, TYR95I, VAL115M, VAL132M, VAL133I, VAL133M, VAL148I, VAL154I, VAL159M, VAL175I, VAL181I, VAL193I, VAL223I, VAL44M, VAL48I