1RUQ

crystal structure (h) of u.v.-irradiated diels-alder antibody 13g5 fab at ph 8.0 with a data set collected in house.

• Total interactions analyzed: 1
• Total true interactions: 1
• Strongest Interaction:
  • Chains: L-H
  • Int. Res.: 192
  • Norm. En. per Res.: -2.7662
• Hub Node: L(1)

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	-30.8254	-26.246	-474.036	-531.1074	192	15	8	18676	2	11	9

Interface residues

• L-H: ALA125H, ALA129H, ALA130H, ALA130L, ALA176H, ALA55L, ALA89L, ALA93H, ALA95H, ARG211L, ARG94H, ASN137L, ASN138L, ASN157L, ASN161L, ASN210L, ASN212L, ASN27L, ASN28L, ASN59H, ASN60H, ASN91L, ASP101H, ASP165L, ASP167L, ASP170L, ASP1L, ASP50H, CYS134L, CYS142H, CYS88L, CYS92H, GLN105H, GLN124L, GLN133H, GLN179H, GLN38L, GLN39H, GLN42L, GLN45L, GLN50L, GLN6L, GLN90L, GLU123L, GLU46H, GLU61H, GLU6H, GLU93L, GLY100H, GLY100L, GLY101L, GLY104H, GLY106H, GLY127H, GLY129L, GLY141H, GLY158L, GLY169H, GLY35H, GLY41L, GLY42H, GLY44H, GLY49H, GLY57L, GLY96H, GLY97H, GLY99L, HIS172H, HIS32L, HIS43H, ILE117L, ILE223H, ILE30L, ILE31L, ILE48H, ILE48L, LEU124H, LEU125L, LEU136L, LEU140H, LEU143H, LEU160L, LEU178H, LEU179L, LEU181L, LEU184H, LEU187H, LEU37L, LEU46L, LEU47L, LEU92L, LEU94L, LYS145H, LYS169L, LYS207L, LYS221H, LYS222H, LYS38H, LYS39L, LYS53L, LYS62H, MET137H, MET175L, MET33L, MET51L, PHE118L, PHE135L, PHE139L, PHE174H, PHE209L, PHE45H, PHE63H, PHE91H, PHE98L, PRO119L, PRO120L, PRO123H, PRO126H, PRO175H, PRO40L, PRO44L, PRO95L, SER116L, SER120H, SER121L, SER122L, SER127L, SER128H, SER131L, SER162L, SER167H, SER168H, SER174L, SER176L, SER177L, SER180H, SER188H, SER189H, SER190H, SER208L, SER43L, SER56L, THR100H, THR107H, THR114L, THR126L, THR134H, THR139H, THR164L, THR168L, THR172L, THR173H, THR178L, THR180L, THR186H, THR192H, THR57H, THR58H, THR97L, TRP103H, TRP157H, TRP163L, TRP33H, TRP35L, TRP36H, TRP47H, TYR102H, TYR122H, TYR173L, TYR185H, TYR34L, TYR36L, TYR49L, TYR86L, TYR87L, TYR96L, TYR98H, TYR99H, VAL115L, VAL121H, VAL132L, VAL133L, VAL138H, VAL144H, VAL159L, VAL171H, VAL177H, VAL191H, VAL226H, VAL37H, VAL85L, VAL89H